Harmonised techniqueNon-exclusive mapping

X-ray diffraction and scattering

XRD, PXRD, SCXRD and grazing-incidence diffraction/scattering, with geometry retained as a subtype.

823primary papers
2,144mapped measurements
9,251linked results
1,031raw method labels
The harmonised label does not replace the method

Every source method stays verbatim. Subtypes retain distinctions such as ATR versus transmission IR, powder versus single-crystal diffraction, and two- versus four-contact transport.

Mapped measurements

Filter source method wording, sample context and scientific purpose.

2,144 measurements

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Rietveld refinement

2026 · Activating a Metallization Switch for Record Hydrogen Evolution in Single-Atom Modified Polar MOF Piezocatalysts

Ni SAs@UiO-66-NH2(Hf) powder · Powder · PXRD using Cu Kalpha radiation; compared UiO-66, UiO-66-NH2 and Ni SAs@UiO-66-NH2.

Diffraction StructureUnspecified subtype

Post-cycling XRD, TEM and SAED

2026 · Bimetallic conductive MOF single crystals designed as high-performance anodes for lithium-ion batteries

CNH electrode after cycling · Electrode · CNH electrode after cycling; XRD after 600 cycles and SEM/TEM/SAED after cycling referenced in SI.

Diffraction StructurePowder

Powder X-ray diffraction

2026 · Bimetallic conductive MOF single crystals designed as high-performance anodes for lithium-ion batteries

CNH (1:1) as-synthesised powder · Powder · Supplementary XRD patterns of CNH(3:1), CNH and CNH(1:1); rendered SI page read visually.

Diffraction StructurePowder

Powder X-ray diffraction

2026 · Bimetallic conductive MOF single crystals designed as high-performance anodes for lithium-ion batteries

CNH (3:1) as-synthesised powder · Powder · Supplementary XRD pattern for CNH(3:1) in the Co/Ni-ratio comparison.

Diffraction StructurePowder

Powder X-ray diffraction

2026 · Bimetallic conductive MOF single crystals designed as high-performance anodes for lithium-ion batteries

CH as-synthesised powder · Powder · Rigaku D/Max-3A, Cu Kalpha radiation, scan rate 8 min^-1; compared with simulated CH pattern.

Diffraction StructurePowder

Powder X-ray diffraction

2026 · Bimetallic conductive MOF single crystals designed as high-performance anodes for lithium-ion batteries

CNH as-synthesised powder · Powder · Rigaku D/Max-3A, Cu Kalpha radiation, scan rate 8 min^-1; compared with CH and simulated pattern.

Diffraction StructurePowder

Powder X-ray diffraction

2026 · Bismuth-based conductive MOF/COF hybrids enable efficient electrochemical heavy metal ion quantification

Bi-HHTP powder/nanobelts · Powder · Crystal structure/phase purity of Bi-HHTP; supporting plot is cited in SI Fig. S1A and checked in the rendered SI surrogate.

Diffraction StructurePowder

Powder X-ray diffraction

2026 · Bismuth-based conductive MOF/COF hybrids enable efficient electrochemical heavy metal ion quantification

COF powder/microspheres · Powder · Crystal structure/phase purity of COF; supporting plot is cited in SI Fig. S1B and checked in the rendered SI surrogate.

Diffraction StructurePowder

Powder X-ray diffraction (Ultima IV)

2026 · Construction of a high-performance electrochemical sensor based on intrinsically conductive Co-HHTQ-MOF for imidacloprid detection

Co-HHTQ-MOF powder · Powder · Experimental XRD spectrum compared with standard simulated spectra.

Diffraction StructurePowder

FTIR and powder XRD

2026 · Electronically Conductive Metal−Organic Framework With Photoelectric and Photothermal Effect as a Stable Cathode for High-Temperature Photo-Assisted Zn/Sn-Air Battery

as-synthesised Ni2DDA black powder · Powder · FTIR coordination analysis; XRD compared with simulated pattern and measured at different temperatures.

Diffraction StructurePowder

Powder XRD, Cu Kalpha radiation

2026 · Facile Preparation of Polymorphic Metal–Organic Framework Nanostructures as Microwave Absorbers via One-Pot Hydrothermal Reaction

Cu-TCNQ powder · Powder · D8 Advanced diffractometer, lambda 1.54178 A, 40 kV, 40 mA.

Diffraction StructurePowder

Powder XRD, Cu Kalpha radiation

2026 · Facile Preparation of Polymorphic Metal–Organic Framework Nanostructures as Microwave Absorbers via One-Pot Hydrothermal Reaction

Fe-TCNQ powder · Powder · D8 Advanced diffractometer, lambda 1.54178 A, 40 kV, 40 mA.

Diffraction StructurePowder

Powder XRD, Cu Kalpha radiation

2026 · Facile Preparation of Polymorphic Metal–Organic Framework Nanostructures as Microwave Absorbers via One-Pot Hydrothermal Reaction

Ni-TCNQ powder · Powder · D8 Advanced diffractometer, lambda 1.54178 A, 40 kV, 40 mA.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD-70003KW)

2026 · In-situ growth of high-crystallinity M3(hexaaminotriphenylene)2 (M = Co, Ni) thin film for field-effect transistor-based glucose biosensor

Co/Ni-HITP (DMF) thin film · Thin Film · Co/Ni-HITP synthesised in DMF/water mixed solvent

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD-70003KW)

2026 · In-situ growth of high-crystallinity M3(hexaaminotriphenylene)2 (M = Co, Ni) thin film for field-effect transistor-based glucose biosensor

Co/Ni-HITP (water) thin film · Thin Film · Co/Ni-HITP aqueous control

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD-70003KW)

2026 · In-situ growth of high-crystallinity M3(hexaaminotriphenylene)2 (M = Co, Ni) thin film for field-effect transistor-based glucose biosensor

Ni-HITP (water) thin film · Thin Film · Ni-HITP aqueous control

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Intrinsically Conductive π-d Conjugated Layers with Co–N4 Active Sites for Efficient Nitrate Electrocatalysis and Zinc-Nitrate Batteries

Co3(HITP)2 powder · Powder · PXRD pattern measured over 2theta = 10-70 deg.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Investigation of charge transport and Schottky properties in a 1D Cd(II) coordination polymer featuring 9-anthracenecarboxylic acid

as-synthesised bulk CP1 · Powder · Bruker D8 Advance, Cu K alpha radiation, lambda = 1.548 A, 40 kV and 40 mA, 2 theta range 5-50 degrees; as-synthesised pattern compared with simulated SCXRD pattern.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SCXRD)

2026 · Investigation of charge transport and Schottky properties in a 1D Cd(II) coordination polymer featuring 9-anthracenecarboxylic acid

CP1 light-yellow block crystals · Single Crystal · Bruker SMART APEX II with graphite-monochromated Mo K alpha radiation, lambda = 0.71073 A; SHELXL-2016/6 refinement; checkCIF/PLATON report supplied.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Metal–(organic cocrystal) framework with a photothermal effect boosting the photocatalytic degradation of pollutants

Ac@[Ca-NDI] MOCF dark-green block single crystals · Single Crystal · PXRD compared Ac@[Ca-NDI] MOCF, Ca-NDI MOF and simulated patterns.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction / CIF crystallographic refinement

2026 · Metal–(organic cocrystal) framework with a photothermal effect boosting the photocatalytic degradation of pollutants

Ac@[Ca-NDI] MOCF dark-green block single crystals · Single Crystal · Cu Kalpha radiation, wavelength 1.54184 A; data collected at 100 K; CCDC 2457159.

Diffraction StructurePowder

powder X-ray diffraction

2026 · Microenvironment modulation in heterometallic MOFs for tailoring electron/proton transport and hydrophilicity toward photocatalytic hydrogen production

Ni-Ca dark brown crystals / powder · Powder

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2026 · Microenvironment modulation in heterometallic MOFs for tailoring electron/proton transport and hydrophilicity toward photocatalytic hydrogen production

Ni-Ca dark brown crystals / powder · Powder

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Microfluidic Printing-Induced Dynamic Splitting of Conductive MOF to Expose High-Density Active Sites for Boosted CO2 Electroreduction

MF-cMOFQx/ty series · Nanosheet · PXRD of MF-cMOFQx/t5 and MF-cMOFQ1.28/ty series; compared with ST-cMOF and simulated patterns.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Microfluidic Printing-Induced Dynamic Splitting of Conductive MOF to Expose High-Density Active Sites for Boosted CO2 Electroreduction

ST-cMOF · Powder · MiniFlex 600 with Cu Kalpha radiation from 3 to 50 degrees; ST-cMOF compared with Cu-HHTP literature.

SpectroscopyUnspecified subtype

XRD, Raman and FTIR

2026 · Nanostructured zinc-doped nickel/iron metal–organic framework electrode material for an efficient energy storage

Activated carbon negative electrode · Electrode · Supplementary activated-carbon structural characterisation

Diffraction StructurePowder

Powder XRD

2026 · Nanostructured zinc-doped nickel/iron metal–organic framework electrode material for an efficient energy storage

Fe-MOF powder · Powder · Cu K alpha radiation, 10-80 degrees 2theta; instrument described as Rigaku Ultima IV, 40 kV, 40 mA

Diffraction StructurePowder

Powder XRD

2026 · Nanostructured zinc-doped nickel/iron metal–organic framework electrode material for an efficient energy storage

Ni/Fe-MOF control powder · Powder · Cu K alpha radiation, 10-80 degrees 2theta; instrument described as Rigaku Ultima IV, 40 kV, 40 mA

Diffraction StructurePowder

Powder XRD

2026 · Nanostructured zinc-doped nickel/iron metal–organic framework electrode material for an efficient energy storage

Ni-MOF powder · Powder · Cu K alpha radiation, 10-80 degrees 2theta; instrument described as Rigaku Ultima IV, 40 kV, 40 mA

Diffraction StructurePowder

Powder XRD

2026 · Nanostructured zinc-doped nickel/iron metal–organic framework electrode material for an efficient energy storage

Zn-doped Ni/Fe-MOF powder before carbonisation · Powder · Cu K alpha radiation, 10-80 degrees 2theta; instrument described as Rigaku Ultima IV, 40 kV, 40 mA

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Structure and Electrical Transport Properties of Metal Cate-Cholate Frameworks: The Metal Center Matters†

Ca-HHTP powder sample · Powder · Rigaku sixth-generation MiniFlex; Cu Kalpha radiation, 600 W (40 kV, 15 mA); powder sample.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Structure and Electrical Transport Properties of Metal Cate-Cholate Frameworks: The Metal Center Matters†

Co-HHTP powder sample · Powder · Rigaku sixth-generation MiniFlex; Cu Kalpha radiation, 600 W (40 kV, 15 mA); powder sample.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Structure and Electrical Transport Properties of Metal Cate-Cholate Frameworks: The Metal Center Matters†

Cu-HHTP powder sample · Powder · Rigaku sixth-generation MiniFlex; Cu Kalpha radiation, 600 W (40 kV, 15 mA); powder sample.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Structure and Electrical Transport Properties of Metal Cate-Cholate Frameworks: The Metal Center Matters†

Mg-HHTP powder sample · Powder · Rigaku sixth-generation MiniFlex; Cu Kalpha radiation, 600 W (40 kV, 15 mA); powder sample.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Structure and Electrical Transport Properties of Metal Cate-Cholate Frameworks: The Metal Center Matters†

Ni-HHTP powder sample · Powder · Rigaku sixth-generation MiniFlex; Cu Kalpha radiation, 600 W (40 kV, 15 mA); powder sample.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2026 · Structure and Electrical Transport Properties of Metal Cate-Cholate Frameworks: The Metal Center Matters†

Zn-HHTP powder sample · Powder · Rigaku sixth-generation MiniFlex; Cu Kalpha radiation, 600 W (40 kV, 15 mA); powder sample.

Diffraction StructurePowder

PXRD

2026 · Structure–Property Engineering of Redox-Active Tetrathiafulvalene- and Bipyridine-Based Metal–Organic Frameworks for Battery Cathodes

Cd2(TTFTB) MOF powder/crystals · Powder · MiniFlex 600, Cu Kalpha1, 2theta 2-30 deg, 20 deg min^-1, 40 kV, 15 mA, RT

Diffraction StructurePowder

PXRD

2026 · Structure–Property Engineering of Redox-Active Tetrathiafulvalene- and Bipyridine-Based Metal–Organic Frameworks for Battery Cathodes

TTF-hybrid-MOF powder/crystals · Powder · MiniFlex 600, Cu Kalpha1, 2theta 2-30 deg, 20 deg min^-1, 40 kV, 15 mA, RT

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2026 · Sub-Femtomolar, Label-Free Small-Molecule Sensing with Nanoarchitectonic Metal-Organic Frameworks

CuHITP/Cu(OH)2 extended-gate electrode · Electrode · Converted CuHITP/Cu(OH)2 nanoarray compared with Cu(OH)2 template and solvothermal CuHITP powder.

Diffraction StructurePowderRefinement

PXRD, Pawley refinement, SEM and HRTEM

2026 · Tailoring Li-ion Storage and Transport in Two-Dimensional Conjugated Metal-Organic Frameworks via Precise Nitrogen Incorporation

Cu-N2-OHBA bulk powder crystals · Powder

Diffraction StructurePowderRefinement

PXRD, Pawley refinement, SEM and HRTEM

2026 · Tailoring Li-ion Storage and Transport in Two-Dimensional Conjugated Metal-Organic Frameworks via Precise Nitrogen Incorporation

Cu-N4-OHBA bulk powder crystals · Powder

Diffraction StructurePowder

Powder X-ray diffraction

2025 · 2D Tetrathiafulvalene-Based Metal–Organic Framework Linked by Hydrogen Bonding for Boosting Long-Cycle Stability of Lithium-Ion Batteries

Activated m-TTFTB-Co-MOF sample · Powder · Bruker D8 Advance diffractometer, Cu radiation lambda = 1.54056 A, 5-60 deg scan range, 0.1 deg s^-1; comparison of as-prepared, activated and simulated PXRD.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2025 · 2D Tetrathiafulvalene-Based Metal–Organic Framework Linked by Hydrogen Bonding for Boosting Long-Cycle Stability of Lithium-Ion Batteries

Red-black bulky crystals of m-TTFTB-Co-MOF · Single Crystal · Bruker APEX-II CCD diffractometer, graphite monochromatic MoKalpha radiation (lambda = 0.71073 A), room temperature; solved by ShelXT and refined on F2.

Diffraction StructurePowder

PXRD after chemical exposure

2025 · A Conductive Cu-Based Metal–Organic Framework Ribbon with High-Density Redox-Active Centers as Cathode for Stable High-Capacity Lithium-Ion Batteries

activated DDA-Cu MOF powder · Powder · Immersion in CH3OH, DMF, DCM, THF, 1 M HCl, 1 M NaOH, and 4 M LiTFSI in DOL/DME for 48 h

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2025 · A Conductive Cu-Based Metal–Organic Framework Ribbon with High-Density Redox-Active Centers as Cathode for Stable High-Capacity Lithium-Ion Batteries

activated DDA-Cu MOF powder · Powder · Powder X-ray diffraction, Cu Kalpha irradiation; simulated and experimental pattern comparison

Diffraction StructurePowder

Powder X-ray diffraction

2025 · A conductive MOF with bimetallic spontaneously recycled systems as a signal enhancer for the ultrasensitive detection of T-2 toxin using an electrochemical aptasensor

Ni3(HITP)2 powder · Powder · PXRD of Ni3(HITP)2 and Co-doped analogues, reported in Fig. S1 and summarised in main text.

Microscopy MorphologyUnspecified subtype

3D SLCM, cross-sectional SEM, EDS mapping and XRD after cycling

2025 · A Cu-based electronically conducting metal–organic framework with π–d conjugation for cathode and anode modification in aqueous zinc-ion batteries

Zn@DDA-Cu composite anode · Electrode · Zn anode morphology before cycling and after 30 cycles at 0.5 mA cm-2/0.5 mAh cm-2.

Electrical TransportUnspecified subtype

SEM/AFM/XRD/XPS/contact angle/electronic conductivity tests

2025 · A Cu-based electronically conducting metal–organic framework with π–d conjugation for cathode and anode modification in aqueous zinc-ion batteries

Zn@DDA-Cu composite anode · Electrode · DDA-Cu-coated zinc anode structural, wetting and conductivity characterisation.

Diffraction StructureGrazing incidence

SAED, AC-HRTEM, FFT, image simulation and GIWAXS

2025 · A Low-Symmetry Copper Benzenehexathiol Coordination Polymer with In-Plane Electrical Anisotropy

Cu5BHT GIWAXS film on silicon · Thin Film · AC-HRTEM at 80 kV with low dose; GIWAXS at BL11 NCD-SWEET, ALBA, 12.4 keV beam, 0.12 deg incidence, 180 s exposure.

Diffraction StructurePowder

Powder X-ray diffraction (Cu Kalpha radiation)

2025 · A mixed-organic ligands Ru(bpy)32+@Zn mMOFs-NH2 nanoreactors integrated co-reaction accelerator and morphologic regulator for the electrochemiluminescence detection of ATP

Ru(bpy)3(2+)@Zn mMOFs-NH2 · Nanosheet · Compared simulated MOF-5, Zn mMOFs-NH2 and Ru(bpy)3(2+)@Zn mMOFs-NH2

Electrochemistry ApplicationUnspecified subtype

CV cycling durability and post-test SEM/XRD

2025 · A novel 2D conductive MOF nanobelts for highly efficient electrosynthesis of hydrogen peroxide

Ni-PTC-60 RRDE catalyst electrode · Electrode · 10,000 CV cycles in 0.1 M KOH; SI states CV in 0.6-0.8 V_RHE for electrode stability.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Advanced dual-signal point-of-care testing platform for sensitive T-2 toxin detection: Integrating copper-based conductive MOF with target-responsive DNA hydrogel

blue-black Cu3(HHTP)2 powder · Powder · Powder Cu3(HHTP)2 characterised to verify phase formation

Diffraction StructurePowder

SEM/EDX, Raman and PXRD

2025 · Ammonia-Assisted Chemical Vapor Deposition Growth of Two-Dimensional Conjugated Coordination Polymer Thin Films

Cu-BHT-w NH3-assisted CVD thin film · Thin Film · Cu-BHT-w structural/morphological confirmation and PXRD comparison with Cu-BHT-o.

Diffraction StructurePowder

SEM/EDX, Raman and PXRD

2025 · Ammonia-Assisted Chemical Vapor Deposition Growth of Two-Dimensional Conjugated Coordination Polymer Thin Films

Cu-HHB-w NH3-assisted CVD thin film · Thin Film · Cu-HHB-w structural/morphological confirmation and PXRD comparison with Cu-HHB-o.

Diffraction StructureGrazing incidence

GIWAXS

2025 · Ammonia-Assisted Chemical Vapor Deposition Growth of Two-Dimensional Conjugated Coordination Polymer Thin Films

Fe-HHB-o CVD thin film without NH3 · Thin Film · GIWAXS at SOLEIL SIRIUS; beam energy 10 keV; incidence angle 0.12 deg; six 30 s images.

Diffraction StructureGrazing incidence

GIWAXS

2025 · Ammonia-Assisted Chemical Vapor Deposition Growth of Two-Dimensional Conjugated Coordination Polymer Thin Films

Fe-HHB-w NH3-assisted CVD thin film · Thin Film · GIWAXS at ESRF ID10; beam energy 22 keV; incidence angle 0.09 deg; 10 s exposure.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · An optoelectronic synapse based on Cu-BHT MOF for multi-wavelength optical logic gates and neuromorphic vision system

Cu-BHT powder for XRD comparison · Powder · XRD pattern of Cu-BHT powder compared with reported Cu-BHT.

Diffraction StructurePowder

PXRD and cRED

2025 · Asymmetrical Substitution Manipulates Stacking Modes in 2D Conductive MOF Crystals

Cu3F2HHTP2 blue powder/rod crystals · Powder · Synchrotron PXRD and cRED/SAED used to assign wavy bridged bilayer structure.

Diffraction StructurePowder

PXRD and cRED

2025 · Asymmetrical Substitution Manipulates Stacking Modes in 2D Conductive MOF Crystals

Cu3FHHTP2 blue powder/rod crystals · Powder · Synchrotron PXRD and cRED/SAED used to assign layered structure and stacking.

Diffraction StructurePowderGrazing incidence

SEM cross-section/top-down imaging and grazing-incidence PXRD

2025 · Beyond diffusion: ion and electron migration contribute to charge transport in redox-conducting metal-organic frameworks

Zn(NDI)@FTO thin film · Thin Film · SEM at 3 kV; PXRD with Cu Kalpha (lambda = 0.15418 nm), 45 kV and 40 mA, parallel beam optics

Diffraction StructurePowder

Post-cycling FTIR, PXRD, SEM, and TEM

2025 · Bimetal MOF nanosheets as efficient anode materials for lithium-ion batteries

Co1/2Fe1/2-MOF LIB anode electrode · Electrode · Co1/2Fe1/2-MOF electrode inspected in discharged, charged, pristine, and cycled states.

Diffraction StructureUnspecified subtype

SEM, XRD and FT-IR

2025 · Catalysis-Assisted Synthesis of Two-Dimensional Conductive Metal–Organic Framework Films with Controllable Orientation

Cu2TBA film, 60 min · Thin Film · Cu2TBA film after 60 min reaction

Diffraction StructureUnspecified subtype

SEM and XRD

2025 · Catalysis-Assisted Synthesis of Two-Dimensional Conductive Metal–Organic Framework Films with Controllable Orientation

face-on Cu3(HHTP)2 film on silicon, 60 min · Thin Film · Top-view/cross-sectional SEM; simulated, in-plane and out-of-plane XRD

Microscopy MorphologyUnspecified subtype

SEM and XRD growth series

2025 · Catalysis-Assisted Synthesis of Two-Dimensional Conductive Metal–Organic Framework Films with Controllable Orientation

edge-on Cu3(HHTP)2 film from air-saturated precursor · Thin Film · air-saturated Cu3(HHTP)2 growth and edge-on orientation

Microscopy MorphologyUnspecified subtype

SEM and XRD growth series

2025 · Catalysis-Assisted Synthesis of Two-Dimensional Conductive Metal–Organic Framework Films with Controllable Orientation

face-on Cu3(HHTP)2 growth-series films · Thin Film · O2-saturated Cu3(HHTP)2 growth from 1 min to 4 h

Diffraction StructureUnspecified subtype

SEM and XRD

2025 · Catalysis-Assisted Synthesis of Two-Dimensional Conductive Metal–Organic Framework Films with Controllable Orientation

edge-on Ni3(HITP)2 film · Thin Film · Edge-on Ni3(HITP)2 film on silicon

Diffraction StructureUnspecified subtype

SEM and XRD

2025 · Catalysis-Assisted Synthesis of Two-Dimensional Conductive Metal–Organic Framework Films with Controllable Orientation

face-on Ni3(HITP)2 film, 60 min · Thin Film · Top-view/cross-sectional SEM and in-plane/out-of-plane XRD

Microscopy MorphologyUnspecified subtype

photography, SEM and XRD

2025 · Catalysis-Assisted Synthesis of Two-Dimensional Conductive Metal–Organic Framework Films with Controllable Orientation

patterned Cu3(HHTP)2 films on varied substrates · Thin Film · Patterned Cu3(HHTP)2 on glass, PDMS, cotton, parylene, PVC, nylon and other supports

Diffraction StructureUnspecified subtype

SEM, EDX, XRD and FT-IR

2025 · Catalysis-Assisted Synthesis of Two-Dimensional Conductive Metal–Organic Framework Films with Controllable Orientation

Zn3(HHTP)2 film, 30 min · Thin Film · Zn3(HHTP)2 film after 30 min reaction

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Catalytic Metal-Organic Framework-Functionalized Inverse-Opal Architectured Polymeric Separator for High-Performance Li-S Batteries

ZIF-PIO-3 separator · Thin Film · ZIF-67, ZIF-PIO and simulated ZIF-67 compared; Cu Kalpha in SI characterisation.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Comparing Ag-O coordinated AgMOF-5 and Ag-N coordinated Ag nanosphere catalytic polymers for real time monitoring of H2O2 level in cancer cells

greyish AgMOF powder · Powder · XRD patterns compared AgMOF and Ag nanosphere crystallinity and phase transformation.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Conductive metal-organic framework synthesis from metal nanoparticle precursors

Cu3(HITP)2 powder scraped from copper foil for PXRD · Powder · Rigaku Miniflex, Cu Kalpha 1.54 A; 2 to 50 deg at 5 deg min-1, 0.02 deg step.

Diffraction StructureUnspecified subtype

Ex situ XRD

2025 · Conductive Metal–Organic Frameworks Anchoring on V3O7·H2O Nanobelts Toward High-Capacity and Long-Life Zinc-Ion Batteries

VO@Cu-HHTP-2 composite cathode electrode · Electrode · VO@Cu-HHTP-2 electrode at different states of the second cycle at 0.1 A g-1.

Diffraction StructureUnspecified subtype

X-ray diffraction (Shimadzu-7000)

2025 · Conductive Metal–Organic Frameworks Anchoring on V3O7·H2O Nanobelts Toward High-Capacity and Long-Life Zinc-Ion Batteries

VO@Cu-HHTP-2 · Nanosheet · As-prepared Cu-HHTP, VO, and VO@Cu-HHTP samples.

Diffraction StructurePowder

PXRD stability check after water and air exposure

2025 · Construction of 1D Molecular Conductive Wires Through a Polarized Gene Weaving Strategy for Efficient Electromagnetic Wave Absorption

Pristine CuTBTT-1D powder/ribbon network · Powder · CuTBTT-1D in water for a week and in air for a month.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Construction of a portable and sensitive electrochemical immunosensor for the rapid detection of erythromycin based on semiconductive bimetallic MOF

As-synthesised CuxFe3-x(HHTP)2 powder · Powder · PXRD pattern used to assign lattice planes and compare with Cu3(HHTP)2 and Fe3(HHTP)2 patterns.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2025 · Construction of nanozyme based with mixed valence manganese oxide loaded on defective metal-organic frameworks for sensitive detection of biomarker procalcitonin

dPCN-224 nanoparticles · Powder · PXRD of dPCN-224; cited as Fig. S3 in incomplete SI text layer but peak positions are reported in main text.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2025 · Construction of nanozyme based with mixed valence manganese oxide loaded on defective metal-organic frameworks for sensitive detection of biomarker procalcitonin

MdP nanoparticles · Powder · PXRD of MdP composite compared with Mn2O3 and Mn3O4 reference patterns.

Diffraction StructurePowder

PXRD before and after heating

2025 · Continuous and reversible tuning of inter-layer spacings in two-dimensional conductive metal organic frameworks

Cu3HHTT2 multi-sample comparison series · Powder · Pristine Cu3HHTT2 compared with heat-treated Cu3HHTT2 at 90 deg C.

Diffraction StructurePowder

PXRD peak full width at half maximum analysis

2025 · Continuous and reversible tuning of inter-layer spacings in two-dimensional conductive metal organic frameworks

Ga9HHTP4 multi-sample comparison series · Powder · FWHM compared for in-plane 4.7 deg peak and inter-layer-stacking 25.8 deg peak.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Continuous and reversible tuning of inter-layer spacings in two-dimensional conductive metal organic frameworks

Pristine Ga9HHTP4 powder · Powder · As-synthesised powder compared with simulated PXRD pattern.

Diffraction StructurePowder

PXRD after solvent exchange

2025 · Continuous and reversible tuning of inter-layer spacings in two-dimensional conductive metal organic frameworks

Ga9HHTP4 multi-sample comparison series · Powder · Heat-treated Ga9HHTP4 soaked in water or organic solvents overnight, then compared by PXRD.

Diffraction StructurePowder

In situ variable-temperature PXRD under reduced pressure

2025 · Continuous and reversible tuning of inter-layer spacings in two-dimensional conductive metal organic frameworks

Heat-treated Ga9HHTP4 (HT-Ga9HHTP4) · Powder · Ga9HHTP4 under reduced pressure; 30 min vacuum at room temperature, then stepwise heating to 85 deg C.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Continuous and reversible tuning of inter-layer spacings in two-dimensional conductive metal organic frameworks

Pristine Ni6HHTT3 powder · Powder · As-synthesised powder compared with simulated PXRD pattern.

Diffraction StructurePowder

Variable-temperature PXRD under reduced pressure

2025 · Continuous and reversible tuning of inter-layer spacings in two-dimensional conductive metal organic frameworks

Heat-treated Ni6HHTT3 · Powder · Ni6HHTT3 under reduced pressure at room temperature and upon heating to 90 deg C.

Diffraction StructureUnspecified subtype

X-ray diffraction (Rigaku Miniflex600)

2025 · Contorted hexabenzocoronene-based two-dimensional conductive metal-organic framework enabled electrochemical platform for monitoring of rutin in pharmaceuticals and biological samples

Cu3(HBC)2 powder · Powder · Powder XRD used to assign Cu3(HBC)2 crystal planes.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Controlling the Spatiotemporal Self-Organization of Stimuli-Responsive Nanocrystals under Out-of-Equilibrium Conditions

1D reaction-diffusion Ni3(HITP)2 Liesegang precipitation zones · Powder · Rigaku MiniFlex, Cu radiation, 3-40 degrees 2theta, 0.02 degree step, 4 degrees min-1 scan rate.

Diffraction StructurePowder

PXRD

2025 · Controlling the Spatiotemporal Self-Organization of Stimuli-Responsive Nanocrystals under Out-of-Equilibrium Conditions

2D RD Ni3(HITP)2 interface particles · Powder · PXRD on particles from interface through Zone 3 of 2D reactor.

Diffraction StructurePowder

PXRD after H2S exposure

2025 · Controlling the Spatiotemporal Self-Organization of Stimuli-Responsive Nanocrystals under Out-of-Equilibrium Conditions

2D RD Ni3(HITP)2 interface particles · Powder · PXRD before and after exposure to 80 ppm and 10000 ppm H2S; 10000 ppm exposure for 2 h also compared across zones and bulk.

Diffraction StructureGrazing incidence

Grazing incidence X-ray diffraction (GIXD)

2025 · Copper-Based Two-Dimensional Conductive Metal-Organic Framework Thin Films for Ultrasensitive Detection of Perfluoroalkyls in Drinking Water

Pristine Cu-HHTP thin films for structural and spectroscopic characterisation · Thin Film · SSRL beamline 11-3, incident energy 12.73 keV, sample-detector distance 317.06 mm, incidence angle 0.1 deg, helium chamber.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Cu─X Bonds Regulated Conduction and Polarization Loss in Conductive Metal-Organic Framework Under Electromagnetic Field

As-synthesised Cu3(HHTP)2 powder · Powder · Cu-Kalpha radiation; 2theta range 2-50 degrees.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Cu─X Bonds Regulated Conduction and Polarization Loss in Conductive Metal-Organic Framework Under Electromagnetic Field

As-synthesised Cu3(HITP)2 powder · Powder · Cu-Kalpha radiation; 2theta range 2-50 degrees.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Cu─X Bonds Regulated Conduction and Polarization Loss in Conductive Metal-Organic Framework Under Electromagnetic Field

As-synthesised Cu3(THT)2 powder · Powder · Cu-Kalpha radiation; 2theta range 2-50 degrees.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2025 · Development of an electrochemiluminescence aptasensor combining covalent-triazine framework emitter with exonuclease III-driven DNA walker for sensitive CEA detection

purified CTF powder · Powder · Experimental PXRD compared with simulated AA and AB eclipsed models; Pawley refinement used AA model.

Diffraction StructureUnspecified subtype

XRD and Raman spectroscopy

2025 · Development of an electrochemiluminescence aptasensor combining covalent-triazine framework emitter with exonuclease III-driven DNA walker for sensitive CEA detection

CuxMn3-x(HITP)2 powder · Powder · Layered conductive MOF structure assessed by XRD peaks and Raman D/G bands.

Diffraction StructureUnspecified subtype

Out-of-plane and in-plane X-ray diffraction

2025 · Dirac-cone induced metallic conductivity in Cu3(HHTP)2: high-quality MOF thin films fabricated via ML-driven robotic synthesis

Optimised Cu3(HHTP)2 SURMOF thin film · Thin Film · Out-of-plane Bruker D8 Advance, 25-31.5 deg 2theta; in-plane Bruker D8 Discover, 3-30 deg 2theta; Cu Kalpha radiation

Diffraction StructurePowder

PXRD and crystallographic structure comparison

2025 · Discovery of Dual Ion-Electron Conductivity of Metal-Organic Frameworks via Machine Learning-Guided Experimentation

MOF 1 as-synthesised crystals/pellet · Pellet · PXRD collected with Cu Kalpha radiation over 5-50 deg 2theta with 0.02 deg step; structure assignment compared to simulated PXRD from CIFs.

Diffraction StructurePowder

PXRD and crystallographic structure comparison

2025 · Discovery of Dual Ion-Electron Conductivity of Metal-Organic Frameworks via Machine Learning-Guided Experimentation

MOF 2 as-synthesised crystals/pellet · Pellet · PXRD collected with Cu Kalpha radiation over 5-50 deg 2theta with 0.02 deg step; structure assignment compared to simulated PXRD from CIFs.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Dual single atomic Fe-Ni sites in N‑doped nanoporous carbon for high-efficiency potassium periodate activation toward pollutant abatement

Fe2Ni1-NC-900 · Powder · Carbonised FeNi-NC catalysts and controls; graphitic carbon peak and absence of metal crystals assessed.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Dual single atomic Fe-Ni sites in N‑doped nanoporous carbon for high-efficiency potassium periodate activation toward pollutant abatement

Fe&Ni-ZnO/ZIF-8 precursor · Powder · PANalytical X'pert diffractometer with Ni-filtered Cu Kalpha radiation at 40 kV/40 mA; precursor patterns compared with ZIF-8.

Diffraction StructurePowder

PXRD, FT-IR, XPS

2025 · Dual-metal sites enable conductive metal-organic frameworks with extraordinary high capacitance for transparent energy storage devices

CuNi-HHTP nanorods · Powder · Phase, coordination, and metal valence analysis of c-MOF samples.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2025 · Electrically Conducting Redox-Complementary Dual-Ligand 2D Graphitic MOF with Orthogonal Charge Transport Pathways

CDL-MOF1 microcrystalline black powder · Powder · Rigaku SmartLab diffractometer with Cu K-alpha radiation (lambda = 1.5406 A) and CCD area detector; SmartLab Studio II used for processing/refinement.

Diffraction StructurePowder

Powder X-ray diffraction comparison

2025 · Electrically Conducting Redox-Complementary Dual-Ligand 2D Graphitic MOF with Orthogonal Charge Transport Pathways

Cu3(HHTP)2 dark blue solid · Powder · PXRD patterns of CDL-MOF1, Cu3(HHTP)2, and Cu3(HHTQ)2 compared in Figure 2 and Figure S1.

Diffraction StructurePowder

PXRD and Raman spectroscopy

2025 · Electro Fenton degradation of glyphosate by incrassated defect-free conductive Cu metal organic framework

10CAT-1 Film · Electrode · Out-of-plane PXRD compared with paper filter and simulated Cu-HHTP; Raman excited at 785 nm.

Diffraction StructurePowder

PXRD and Raman spectroscopy

2025 · Electro Fenton degradation of glyphosate by incrassated defect-free conductive Cu metal organic framework

CAT-1 Film · Electrode · Out-of-plane PXRD compared with paper filter and simulated Cu-HHTP; Raman excited at 785 nm.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Electrochemical Synthesis of Cu3(HHTP)2Metal–Organic Frameworks from Cu Nanoparticles for Chemiresistive Gas Sensing

Electrochemically synthesised Cu3(HHTP)2 scraped powder (from Cu tape scale-up) · Powder · Rigaku Miniflex, Cu Kalpha 1.54 A, 2-40 deg at 5 deg/min, 0.02 deg step; scraped powder from Cu-tape scale-up

Diffraction StructurePowder

PXRD of dropcast films after sonication

2025 · Employing Triphenylene-Based, Layered, Conductive Metal-Organic Framework Materials as Electrochemical Sensors for Nitric Oxide in Aqueous Media

Ni3(HHTP)2 dropcast on glassy carbon electrode · Electrode · Dropcast HHTP MOF films after 5 h sonication compared with powder and simulated stacking patterns.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Employing Triphenylene-Based, Layered, Conductive Metal-Organic Framework Materials as Electrochemical Sensors for Nitric Oxide in Aqueous Media

Co3(HHTP)2 microcrystalline powder · Powder · Rigaku Miniflex, Cu Kalpha radiation; compared with simulated ABAB and AAAA stacking patterns.

Diffraction StructurePowderRefinement

Powder X-ray diffraction (XRD/PXRD) with Pawley refinement

2025 · Enhanced conductivity and energy storing performances of 3D bimetallic conductive metal-organic frameworks based on linear π-conjugated thiazole for supercapacitors

NiCo-DPTTZ-MOF powder, ratio not defined · Powder · XRD patterns of targeted MOF electrode materials and Pawley refinement of bimetallic NiCo-DPTTZ-MOF

Diffraction StructurePowderRefinement

PXRD and MicroED/Pawley structural analysis

2025 · Enhanced Electrical Conductivity by the Heavy Chalcogen Effect in Metal-Organic Frameworks

Cu-S-HHS solvothermal powder · Powder · Cu-S-HHS solved by MicroED at 77 K; Se/Te models Pawley-refined against PXRD.

Diffraction StructurePowderRefinement

PXRD and MicroED/Pawley structural analysis

2025 · Enhanced Electrical Conductivity by the Heavy Chalcogen Effect in Metal-Organic Frameworks

Cu-Se-HHS solvothermal powder · Powder · Cu-S-HHS solved by MicroED at 77 K; Se/Te models Pawley-refined against PXRD.

Diffraction StructurePowderRefinement

PXRD and MicroED/Pawley structural analysis

2025 · Enhanced Electrical Conductivity by the Heavy Chalcogen Effect in Metal-Organic Frameworks

Cu-Te-HHS solvothermal powder · Powder · Cu-S-HHS solved by MicroED at 77 K; Se/Te models Pawley-refined against PXRD.

Microscopy MorphologyUnspecified subtype

SEM, TEM, EDS mapping, and XRD

2025 · Enhancing pancreatic cancer ablation efficiency: bipolar IRE with conductive MOF

Ni3(HITP)2@PDA nanoparticles · Powder · Morphology and structural-retention comparison of pristine Ni3(HITP)2 and PDA-coated Ni3(HITP)2@PDA.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Enhancing the Electrochemical Energy Storage of Metal-Organic Frameworks: Linker Engineering and Size Optimization

Primary Ni-MOF powder series · Powder · Bruker D8 Advanced X-ray diffractometer, Cu Kα radiation λ = 0.15406 nm; comparison with simulated patterns

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha radiation

2025 · Extension of charge separation distance over isolated dual-metal sites in metal-organic frameworks for efficient CO2 photoreduction

Cu-THQ powder · Powder · Rigaku XRD-6000, 40 kV, 30 mA, scan step 0.02 deg; compared with simulated and reported Cu-THQ patterns.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2025 · Extension of charge separation distance over isolated dual-metal sites in metal-organic frameworks for efficient CO2 photoreduction

CuCo-THQ powder · Nanosheet · Cu-THQ and CuM-THQ PXRD compared with simulated Cu-THQ pattern; broad 8 deg and 16 deg peaks attributed to limited long-range order.

Diffraction StructureUnspecified subtype

Post-NRA SEM, XRD and XPS stability characterisation

2025 · Fabrication of a Novel Cu Based Conjugated Coordination Polymer for Effective Electroreduction of Nitrate to Ammonia and Zn–Nitrate Batteries

Cu3(HITP)2/CF pine-like electrode · Electrode · Cu3(HITP)2/CF characterised after NRA by SEM, XRD and Cu 2p XPS in SI Figures S18-S20.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Fabrication of a Novel Cu Based Conjugated Coordination Polymer for Effective Electroreduction of Nitrate to Ammonia and Zn–Nitrate Batteries

Cu3(HHTP)2/CF pine-like comparison electrode · Electrode · XRD pattern of Cu3(HHTP)2/CF.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Fabrication of a Novel Cu Based Conjugated Coordination Polymer for Effective Electroreduction of Nitrate to Ammonia and Zn–Nitrate Batteries

Cu3(HITP)2/CF pine-like electrode · Electrode · XRD pattern of Cu3(HITP)2/CF.

Diffraction StructurePowder

Post-electrolysis PXRD and XPS

2025 · Fibrous Pb(II)-Based Coordination Polymer Operable as a Photocatalyst and Electrocatalyst for High-Rate, Selective CO2-to-Formate Conversion

KGF-9 electrode after electrolysis · Electrode · KGF-9/KB electrode after electrolysis at -0.6 to -1.0 V vs RHE for 120 min under CO2 or Ar.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Rigaku MiniFlex600, Cu-Kalpha

2025 · Fibrous Pb(II)-Based Coordination Polymer Operable as a Photocatalyst and Electrocatalyst for High-Rate, Selective CO2-to-Formate Conversion

MW_x KGF-9/KGF-17 comparison powder series · Powder · PXRD patterns compared for simulated/ordinary KGF-9, KGF-17 and MW_x powders.

Diffraction StructurePowder

PXRD stability test after soaking

2025 · Fibrous Pb(II)-Based Coordination Polymer Operable as a Photocatalyst and Electrocatalyst for High-Rate, Selective CO2-to-Formate Conversion

MW_60 fibrous KGF-9 powder · Powder · MW_60 soaked in water, 0.1 M NaOH, 0.5 M KHCO3, DMSO and 0.1 M HCl.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Flexible 8 V planar supercapacitors: Unleashing ionic liquid transport via Co/Ni/Mn-MOFs nanorod pore-channel modulation

Co-MOF powder · Powder · Cu K alpha radiation per SI; main text compares peaks for Co-MOF, Ni-MOF and Mn-MOF.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Flexible 8 V planar supercapacitors: Unleashing ionic liquid transport via Co/Ni/Mn-MOFs nanorod pore-channel modulation

Mn-MOF powder · Powder · Cu K alpha radiation per SI; main text compares peaks for Co-MOF, Ni-MOF and Mn-MOF.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Flexible 8 V planar supercapacitors: Unleashing ionic liquid transport via Co/Ni/Mn-MOFs nanorod pore-channel modulation

Ni-MOF powder · Powder · Cu K alpha radiation per SI; main text compares peaks for Co-MOF, Ni-MOF and Mn-MOF.

Diffraction StructurePowder

Powder X-ray diffraction with Cu-Kalpha radiation, 40 kV, 30 mA

2025 · Flexible conductive metal-organic framework Cu3(HHTP)2 film with high thermoelectric performance for low-grade heat harvesting

Optimised Cu3(HHTP)2/Nylon hot-pressed film at 353 K · Thin Film · XRD comparison of Cu3(HHTP)2 nanorods, nylon membrane and hot-pressed Cu3(HHTP)2/Nylon films.

Diffraction StructureUnspecified subtype

XRD plus UV-vis/Tauc analysis of ZnO film

2025 · From Rigid to Flexible: Ce-BTC-MOF-Enabled Self-Powered Photodetectors with Record-High Responsivity and Detectivity

ZnO film used in flexible Ce-BTC/ZnO device · Thin Film · ZnO film deposited on glass; XRD compared to hexagonal wurtzite ZnO and UV-vis Tauc band gap calculated.

Diffraction StructurePowder

Laboratory powder X-ray diffraction (PXRD)

2025 · High-resolution structure of Zn3(HOTP)2 (HOTP = hexaoxidotriphenylene), a three-dimensional conductive MOF

Zn3(HOTP)2 samples synthesised under three reported procedure classes for PXRD comparison · Powder · Bruker Advance II diffractometer, theta/2theta reflection geometry, Ni-filtered Cu Kalpha radiation; thin layer on zero-background silicon crystal plate.

Diffraction StructureGrazing incidence

2D GIWAXS

2025 · Highly Porous, Electrically Conductive Two-Dimensional Nickel–Hexaaminodehydrobenzoannulene Frameworks

Ni3(HI12)2 film on interdigitated Au electrodes · Thin Film · beamline BL19B2 at SPring-8; 12.398 keV, incident angle 0.12 deg; 30 s exposure

Diffraction StructureGrazing incidence

2D GIWAXS

2025 · Highly Porous, Electrically Conductive Two-Dimensional Nickel–Hexaaminodehydrobenzoannulene Frameworks

Ni3(HI18)2 film on interdigitated Au electrodes · Thin Film · beamline BL19B2 at SPring-8; 12.398 keV, incident angle 0.12 deg; 30 s exposure

Diffraction StructureGrazing incidence

2D GIWAXS

2025 · Highly Porous, Electrically Conductive Two-Dimensional Nickel–Hexaaminodehydrobenzoannulene Frameworks

Ni3(HITP)2 film on interdigitated Au electrodes · Thin Film · beamline BL19B2 at SPring-8; 12.398 keV, incident angle 0.12 deg; 30 s exposure

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2025 · Highly Porous, Electrically Conductive Two-Dimensional Nickel–Hexaaminodehydrobenzoannulene Frameworks

Ni3(HI12)2 activated powder · Powder · Cu Kalpha, 2theta 1-30 deg, P6/mmm AA-stacking model refinement

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2025 · Highly Porous, Electrically Conductive Two-Dimensional Nickel–Hexaaminodehydrobenzoannulene Frameworks

Ni3(HI18)2 activated powder · Powder · Cu Kalpha, 2theta 1-30 deg, P6/mmm AA-stacking model refinement

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2025 · Highly Porous, Electrically Conductive Two-Dimensional Nickel–Hexaaminodehydrobenzoannulene Frameworks

Ni3(HITP)2 activated powder · Powder · Cu Kalpha, 2theta 1-30 deg, P6/mmm AA-stacking model refinement

Diffraction StructurePowder

powder/rod X-ray diffraction

2025 · Highly sensitive and selective electrochemical sensor for carbendazim detection in fruit juice using novel bi-metallic metal organic framework anchored graphite rod electrode

Self-standing Ni-Fe(PDC)/GR electrode · Electrode · Rigaku instrument, 40 kV, 20 mA, Cu Kalpha radiation, wavelength 0.154 nm; pure graphite and MOF-deposited graphite rods.

Diffraction StructureUnspecified subtype

XRD after immersion in pH 7.0-11.0 solutions

2025 · Highly sensitive electrochemiluminescence glucose sensor under alkaline conditions based on glucose oxidase@conductive metal-organic framework nanocapsules

GOx@Zn-HHTP nanocapsule powder · Powder · GOx@Zn-HHTP immersed in solutions of different pH, separated, dried, and tested by XRD.

Diffraction StructurePowder

Powder X-ray diffraction (Cu K alpha, lambda = 1.5418 A)

2025 · Highly sensitive electrochemiluminescence glucose sensor under alkaline conditions based on glucose oxidase@conductive metal-organic framework nanocapsules

GOx@ZIF-8 precursor nanoparticles · Powder · Ambient-temperature XRD comparison of precursor with ZIF-8.

Diffraction StructurePowder

Powder X-ray diffraction (Cu K alpha, lambda = 1.5418 A)

2025 · Highly sensitive electrochemiluminescence glucose sensor under alkaline conditions based on glucose oxidase@conductive metal-organic framework nanocapsules

GOx@Zn-HHTP nanocapsule powder · Powder · Phase assignment after transformation from GOx@ZIF-8 to Zn-HHTP.

Diffraction StructureUnspecified subtype

In-plane and out-of-plane X-ray diffraction

2025 · Impact of the Channel Length in Nanoporous Electric Double-Layer Capacitors on the Charge Transport Explored by Metal-Organic Framework Films

Cu3(HHTP)2 SURMOF synthesis-cycle series · Thin Film · Bruker D8 ADVANCE X-ray diffractometer with Cu K alpha radiation; 20- and 200-cycle SURMOF films compared with calculated XRD pattern.

Diffraction StructureUnspecified subtype

X-ray diffraction with simulated patterns

2025 · In situ construction of a dual-metal 2D conjugated metal-organic framework on carbon paper for asymmetric supercapacitors

M1/M2-HHTP powder series · Powder · XRD patterns collected for bimetallic M1/M2-HHTP and compared with Materials Studio simulations; SI reports Bruker D8 Advance, Cu K alpha, lambda = 1.5406 A, 2theta = 3-50 degrees.

Diffraction StructurePowderRefinement

synchrotron PXRD/Rietveld plus SEM/HRTEM after cycling

2025 · In Situ Construction of Amide-Functionalized 2D Conjugated Metal-Organic Frameworks with Multiple Active Sites for High-Performance Potassium-Ion Batteries

Cu-HBB-MOF cathode electrode in CR2025 potassium half-cell · Electrode · pristine, discharged and charged states; long-term cycled state

Diffraction StructurePowderRefinement

synchrotron PXRD and Rietveld refinement

2025 · In Situ Construction of Amide-Functionalized 2D Conjugated Metal-Organic Frameworks with Multiple Active Sites for High-Performance Potassium-Ion Batteries

as-synthesised Cu-HBB-MOF black powder · Powder · BL17B/BL17B1 SSRF, lambda = 1.2398 A; 2theta 2-30 deg full-profile Rietveld

Diffraction StructurePowderRefinement

synchrotron PXRD and Rietveld refinement

2025 · In Situ Construction of Amide-Functionalized 2D Conjugated Metal-Organic Frameworks with Multiple Active Sites for High-Performance Potassium-Ion Batteries

as-synthesised Cu-Salphen-MOF black powder · Powder · BL17B/BL17B1 SSRF, lambda = 1.2398 A; 2theta 2-30 deg full-profile Rietveld

Diffraction StructurePowder

powder X-ray diffraction (XRD)

2025 · Ligand engineering of Co-MOF-74 with hexaaminotriphenylene for enhanced oxygen reduction reaction in zinc-air batteries

Co-MOF-74-HATP powder · Powder · XRD comparison of Co-MOF-74, Co-MOF-74-HATP and simulated Co-MOF-74; SI reports Rigaku Smart Lab, Cu K-alpha radiation, lambda=0.15405 nm, 40 kV, 30 mA.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement against DFT-optimized AA-serrated model

2025 · Ligand-Insertion Strategy for Constructing 2D Conjugated Metal–Organic Framework with Large Pore Size for Electrochemical Analytics

As-prepared Cu3(HHTP)(DHBQ)1.5/1.53 black powder · Powder · PXRD collected with Cu Kalpha radiation over 2-50 deg 2theta; Pawley refinement using Reflex module in BIOVIA Materials Studio 2018.

OtherPowder

Thermogravimetric analysis, solvent-immersion PXRD, salt-immersion PXRD/EDS and zeta potential

2025 · Ligand-Insertion Strategy for Constructing 2D Conjugated Metal–Organic Framework with Large Pore Size for Electrochemical Analytics

As-prepared Cu3(HHTP)(DHBQ)1.5/1.53 black powder · Powder · TG in N2 from ambient to 700 deg C at 10 deg C min-1; solvent immersion for 3 days; saturated NaCl/KCl overnight; zeta potential in ultrasonicated deionized-water suspension.

Diffraction StructurePowder

PXRD screening of synthetic products from solvothermal and liquid-liquid interfacial conditions

2025 · Ligand-Insertion Strategy for Constructing 2D Conjugated Metal–Organic Framework with Large Pore Size for Electrochemical Analytics

As-prepared Cu3(HHTP)(DHBQ)1.5/1.53 black powder · Powder · Solvothermal and interface synthesis products compared by PXRD; high crystallinity achieved for n-butanol/H2O = 1/1, en, 65 deg C, 24 h or 48 h in Table S2.

Diffraction StructurePowder

X-ray diffraction (XRD, X'Pert3 Powder, PANalytical)

2025 · Manganese oxide and urea-assisted engineering of nickel-iron compounds for high-performance battery-supercapacitor hybrid devices

NiFe · Electrode · Compared with standard MnO2, NiFe-LDH, FeOOH, NiOOH and simulated Fe-MOF/Ni-MOF patterns.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Manganese oxide and urea-assisted engineering of nickel-iron compounds for high-performance battery-supercapacitor hybrid devices

NiFe-Mn1 · Electrode · Mn/urea-modified NiFe-MOF series compared with reference phases.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Manganese oxide and urea-assisted engineering of nickel-iron compounds for high-performance battery-supercapacitor hybrid devices

NiFe-Mn2 · Electrode · Mn/urea-modified NiFe-MOF series compared with reference phases.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Manganese oxide and urea-assisted engineering of nickel-iron compounds for high-performance battery-supercapacitor hybrid devices

NiFe-Mn3 · Electrode · Mn/urea-modified NiFe-MOF series compared with reference phases.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Manganese oxide and urea-assisted engineering of nickel-iron compounds for high-performance battery-supercapacitor hybrid devices

NiFe-Mn4 · Electrode · Mn/urea-modified NiFe-MOF series compared with reference phases.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Manganese oxide and urea-assisted engineering of nickel-iron compounds for high-performance battery-supercapacitor hybrid devices

NiFe-Mn3 without urea · Electrode · SI comparison of NiFe-Mn3 with and without urea; numeric trace unavailable in provided SI text.

Diffraction StructurePowder

powder X-ray diffraction (PXRD), Cu Kalpha

2025 · Mechanistic Insight into the Formation and Deposition of Conductive, Layered Metal-Organic Framework Nanocrystals

homogeneous DMF/water air plus H2O2 Ni3(HHTP)2, 85 C · Powder · background-corrected/normalised and raw traces compared with simulated ABAB pattern

Diffraction StructurePowder

powder X-ray diffraction (PXRD), Cu Kalpha

2025 · Mechanistic Insight into the Formation and Deposition of Conductive, Layered Metal-Organic Framework Nanocrystals

heterogeneous water bubbled-air Ni3(HHTP)2, 85 C · Powder · background-corrected/normalised and raw traces compared with simulated ABAB pattern

Diffraction StructurePowder

powder X-ray diffraction (PXRD), Cu Kalpha

2025 · Mechanistic Insight into the Formation and Deposition of Conductive, Layered Metal-Organic Framework Nanocrystals

homogeneous DMF/water bubbled-air Ni3(HHTP)2, 85 C · Powder · background-corrected/normalised and raw traces compared with simulated ABAB pattern

Diffraction StructurePowder

powder X-ray diffraction (PXRD), Cu Kalpha

2025 · Mechanistic Insight into the Formation and Deposition of Conductive, Layered Metal-Organic Framework Nanocrystals

homogeneous DMF/water N2 plus H2O2 Ni3(HHTP)2, 85 C · Powder · background-corrected/normalised and raw traces compared with simulated ABAB pattern

Diffraction StructurePowder

powder X-ray diffraction (PXRD), Cu Kalpha

2025 · Mechanistic Insight into the Formation and Deposition of Conductive, Layered Metal-Organic Framework Nanocrystals

homogeneous DMF/water bubbled-N2 Ni3(HHTP)2, 85 C · Powder · background-corrected/normalised and raw traces compared with simulated ABAB pattern

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

CdI2@NU-600 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

NiBr2@PCN-700 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

PbBr2@PCN-606 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

PbBr2@PCN-700 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

PbI2@NU-1000 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

PbI2@NU-600 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

PbI2@PCN-606 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

PbI2@PCN-609 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructurePowderSingle crystal

SC-XRD and PXRD

2025 · Metal-halide porous framework superlattices

PbI2@PCN-700 single crystals · Single Crystal · Single-crystal XRD for atomic structure; PXRD compared with simulated patterns

Diffraction StructureUnspecified subtype

XRD and HR-TEM of cycled cathodes

2025 · Metal-organic framework glass stabilizes high-voltage cathodes for efficient lithium-metal batteries

Glass@NCM-811, 2 wt% MOF Glass coating · Powder · Cycled Glass@NCM-811 and bare NCM-811 after electrochemical cycling; XRD I003/I104 and TEM/FTIR surface analysis.

Electrochemistry ApplicationUnspecified subtype

Water immersion followed by XRD and coin-cell cycling

2025 · Metal-organic framework glass stabilizes high-voltage cathodes for efficient lithium-metal batteries

Glass@NCM-811, 2 wt% MOF Glass coating · Powder · Glass@NCM-811 cathode immersed in water for 7 days then assembled into Li coin cell.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Metal-organic framework glass stabilizes high-voltage cathodes for efficient lithium-metal batteries

Bulk Zn-P-dmbIm MOF Glass · Unknown · Cu-Kalpha XRD, scan rate 0.016 deg/s; compares Zn-P-dmbIm MOF powder, MOF liquid and MOF Glass.

Diffraction StructureUnspecified subtype

X-ray diffraction (PANalytical X'PERT Pro)

2025 · Metal-Organic Framework-Based Tribovoltaic Textile for Human Body Signal Monitoring

Cu-BHT powder reference · Powder · Cu-BHT powder, Cu-BHT cotton, and pristine cotton comparison

Diffraction StructureGrazing incidence

2D-GIWAXS of C10-DNTT on dielectric layers

2025 · Metal–Organic Frameworks Coordination-Oriented Polymer Dielectrics for Neuromorphic Vision Sensors

PM1-based NeuVS OFET · Electrode · GIWAXS data for C10-DNTT on PAA, PM1, and PM2; in-plane diffraction fitting parameters from SI Table S3.

Diffraction StructureGrazing incidence

1D-XRD and 2D-GIWAXS

2025 · Metal–Organic Frameworks Coordination-Oriented Polymer Dielectrics for Neuromorphic Vision Sensors

PM1 (PAA-MOF-1) dielectric film · Thin Film · 1D-XRD scanning 2theta from 2 to 30 degrees; 2D-GIWAXS at 3C beamline, lambda = 0.1230 nm.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Micro-sized conductive metal–organic framework nanosheets for the electrochemical hydrogen evolution reaction in acidic media

Fe-HITP nanoparticles/aggregate · Powder · Cu Kα radiation; scan rate 10° min^-1 per SI.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Micro-sized conductive metal–organic framework nanosheets for the electrochemical hydrogen evolution reaction in acidic media

Ni-HITP nanoparticles (Ni-HITP NPs) · Powder · Cu Kα radiation; scan rate 10° min^-1 per SI.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Micro-sized conductive metal–organic framework nanosheets for the electrochemical hydrogen evolution reaction in acidic media

Zn-HITP nanoparticles/aggregate · Powder · Cu Kα radiation; scan rate 10° min^-1 per SI.

OtherUnspecified subtype

Product yield and XRD/SEM for TMAH dilution series

2025 · Micro-sized conductive metal–organic framework nanosheets for the electrochemical hydrogen evolution reaction in acidic media

Ni-HITP NS TMAH dilution series · Nanosheet · Ni-HITP NS synthesis in serially diluted TMAH solutions.

Diffraction StructurePowder

PXRD/XRD

2025 · Mitigating lipid biofouling in wearable sweat sensors: A study on conductive MOF-based electrodes with tuned hydrophilicity

Cu-HHTP electrode · Electrode · Experimental pattern compared with simulated MOF pattern

Diffraction StructurePowder

PXRD/XRD

2025 · Mitigating lipid biofouling in wearable sweat sensors: A study on conductive MOF-based electrodes with tuned hydrophilicity

Cu-HHTP/OTS electrode · Electrode · Experimental pattern compared with simulated MOF pattern

Diffraction StructurePowder

PXRD/XRD

2025 · Mitigating lipid biofouling in wearable sweat sensors: A study on conductive MOF-based electrodes with tuned hydrophilicity

Cu-THQ electrode · Electrode · Experimental pattern compared with simulated MOF pattern

Diffraction StructurePowder

PXRD/XRD

2025 · Mitigating lipid biofouling in wearable sweat sensors: A study on conductive MOF-based electrodes with tuned hydrophilicity

Ni-HHTP electrode · Electrode · Experimental pattern compared with simulated MOF pattern

Diffraction StructurePowder

PXRD/XRD

2025 · Mitigating lipid biofouling in wearable sweat sensors: A study on conductive MOF-based electrodes with tuned hydrophilicity

ZIF-8 electrode · Electrode · Experimental pattern compared with simulated MOF pattern

Diffraction StructurePowder

Powder X-ray diffraction, Cu Kalpha radiation

2025 · Mixed Ionic and Electronic Conductivity in a Tetrathiafulvalene-Phosphonate Metal-Organic Framework

TTFTP-La MOF bulk dark crystals · Powder · PXRD after heating to RT/100/200/300 °C and after aqueous/solvent treatments for 24 h.

Diffraction StructurePowder

powder XRD indexing / Le Bail profile fitting

2025 · Mixed proton-electron conductivity in a dynamic 3D metal-organic framework

H12-Fe2-(DOBDP)3 (_d) · Powder · PXRD data for Fe partially hydrated, partially dehydrated and dehydrated phases refined/indexed in P-1 using Expo2014/Expo2024.

Diffraction StructurePowder

powder X-ray diffraction

2025 · Mixed proton-electron conductivity in a dynamic 3D metal-organic framework

H12-(Fe-Al-Sc-In)2-(DOBDP)3_h · Powder · Powder XRD patterns for five isostructural Al, Fe, Sc, In monometallic and Fe-Al-Sc-In tetrametallic MOFs.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (Mo-Kalpha, 150 K)

2025 · Mixed proton-electron conductivity in a dynamic 3D metal-organic framework

H12-Al2-(DOBDP)3 super-hydrated single crystals · Single Crystal · MAR345 image-plate detector, Mo-Kalpha radiation, crystal flash cooled to 150 K under N2.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (Mo-Kalpha, 150 K)

2025 · Mixed proton-electron conductivity in a dynamic 3D metal-organic framework

H12-Fe2-(DOBDP)3.21H2O (_sh) single crystal / mixed phase · Single Crystal · MAR345 image-plate detector, Mo-Kalpha radiation, crystal flash cooled to 150 K under N2.

Microscopy MorphologyPowder

paper sensor morphology/PXRD/EDS

2025 · Modulating the redox states in a 3D conductive MOF for sweat ascorbic acid monitoring

I2@FeTHQ/FP paper sensor · Thin Film · PXRD before/after bending; SEM/EDS on paper fibres

Diffraction StructurePowder

PXRD

2025 · Modulating the redox states in a 3D conductive MOF for sweat ascorbic acid monitoring

I2@FeTHQ, 20 C 6 h · Powder · Cu K-alpha PXRD comparing FeTHQ, I2@FeTHQ and simulated pattern

PorositySingle crystal

SC-XRD-derived pore description

2025 · Morphological control of a metal-organic framework for single-crystal electronic device fabrication

Zn-9 large Zn2(TTFTB) crystals · Single Crystal · Pore diameter inferred from solved crystal structure; no gas sorption reported

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2025 · Morphological control of a metal-organic framework for single-crystal electronic device fabrication

Zn-1 to Zn-8 PXRD powder series · Powder · Bruker D8 Advance, Cu source, 40 kV/40 mA, 0.02 deg step, 2 s per step; samples on zero-background silicon

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2025 · Morphological control of a metal-organic framework for single-crystal electronic device fabrication

Zn-9 large Zn2(TTFTB) crystals · Single Crystal · PXRD pattern compared with simulated Zn2(TTFTB), H4TTFTB, newly solved and prior structures

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SC-XRD)

2025 · Morphological control of a metal-organic framework for single-crystal electronic device fabrication

H4TTFTB single crystals · Single Crystal · Bruker D8 Venture; H4TTFTB taken directly from mother liquor and measured at 100 K

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SC-XRD)

2025 · Morphological control of a metal-organic framework for single-crystal electronic device fabrication

Zn-9 large Zn2(TTFTB) crystals · Single Crystal · Bruker D8 Venture with PHOTON III detector, Excillum liquid Ga Kalpha source; data collection reported at 297 K in main/SI table

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2025 · Multifunctional covalent organic framework with extended π-d conjugated structure for lithium-sulfur batteries

as-synthesised Ni-COF powder/precipitate · Powder · Rigaku B/Max-RB, Cu-Kalpha lambda = 0.154 nm; experimental and simulated PXRD compared

Diffraction StructurePowder

PXRD after solvent soaking

2025 · Multifunctional covalent organic framework with extended π-d conjugated structure for lithium-sulfur batteries

as-synthesised Ni-COF powder/precipitate · Powder · Ni-COF soaked 72 h in DMF, NMP, DOL, DME, EtOH and THF

Electrical TransportUnspecified subtype

Unencapsulated ageing stability by XRD and photoresponse

2025 · Multilevel Chiral Semiconductor Metal-Peptide Framework Thin Film for Highly Circularly Polarized Visible Photodetection

CAS-4 thin film-based Au photodetector · Electrode · CAS-4 thin film stored directly in air for one month; SI text specifies 25 C, 45% RH; fresh and one-month LCP/RCP photoresponse compared.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2025 · Multilevel Chiral Semiconductor Metal-Peptide Framework Thin Film for Highly Circularly Polarized Visible Photodetection

Blue bulk CAS-4 crystals · Single Crystal · Ga Kalpha radiation, lambda = 1.54184 Angstrom; crystal data refined for CAS-4 at 100.00(10) K.

Diffraction StructureGrazing incidence

Out-of-plane XRD, in-plane XRD and GIWAXS

2025 · Multilevel Chiral Semiconductor Metal-Peptide Framework Thin Film for Highly Circularly Polarized Visible Photodetection

Highly oriented CAS-4 thin film grown for 20 LPE-LBL cycles · Thin Film · Out-of-plane and in-plane XRD patterns for CAS-4 thin film grown over 20 cycles; GIWAXS used to identify lattice and film orientation.

Diffraction StructurePowder

Powder XRD before and after water splitting

2025 · Nano UiO-66 and UiO-66-NH2 MOFs as Bifunctional Electrocatalysts for Water-Splitting: A Comparative Study

U post-water-splitting SI electrode · Electrode · Repeated electrochemical measurements and stability tests followed by XRD to assess framework structural changes; nickel foam pattern also included.

Diffraction StructurePowder

Powder XRD before and after water splitting

2025 · Nano UiO-66 and UiO-66-NH2 MOFs as Bifunctional Electrocatalysts for Water-Splitting: A Comparative Study

U-N post-water-splitting SI electrode · Electrode · Repeated electrochemical measurements and stability tests followed by XRD to assess framework structural changes; nickel foam pattern also included.

Diffraction StructurePowderRefinement

PXRD Pawley refinement

2025 · Nanoporous synthetic metal: A nickel MOF with an amino-functionalized macrocyclic ligand

Cu-HATC powders · Powder · PXRD fitted against simulated packing modes; slipped AA best fit

Diffraction StructurePowder

PXRD comparison

2025 · Nanoporous synthetic metal: A nickel MOF with an amino-functionalized macrocyclic ligand

Cu-HHTC powders · Powder · PXRD patterns of Cu-HHTC compared to Cu-HATC and Ni-HATC

Diffraction StructurePowder

thin-film powder X-ray diffraction (PXRD)

2025 · Nanoporous synthetic metal: A nickel MOF with an amino-functionalized macrocyclic ligand

Ni-HATC thin film on glass · Thin Film · Ni-HATC thin-film pattern compared directly with bulk powder

Diffraction StructurePowderRefinement

PXRD Pawley refinement

2025 · Nanoporous synthetic metal: A nickel MOF with an amino-functionalized macrocyclic ligand

Ni-HATC bulk powders · Powder · PXRD fitted against simulated packing modes; Cu K alpha wavelength 1.5418 A

Diffraction StructurePowder

variable-temperature PXRD

2025 · Nanoporous synthetic metal: A nickel MOF with an amino-functionalized macrocyclic ligand

Ni-HATC bulk powders · Powder · Ni-HATC heated at RT, 40, 60, 80 and 100 C for 1 h

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha radiation

2025 · Operando Raman and ex situ characterization of an iron-based conductive MOF as a negative electrode in Li-ion batteries

synthesised Fe-HHTP powder · Powder · D-Max Rigaku Ru300 rotating anode; 3-50 degrees 2theta; 0.03 degree step; 1 s per step.

Diffraction StructurePowder

PXRD of fresh Fe-HHTP electrode

2025 · Operando Raman and ex situ characterization of an iron-based conductive MOF as a negative electrode in Li-ion batteries

Fresh and cycled Fe-HHTP composite electrodes stopped at 0.1 V or 3 V · Electrode · 5-35 degrees 2theta; 0.03 degree step; 2 s per step for the fresh electrode.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Photoactivated conductive MOF thin film arrays on micro-LEDs for chemiresistive gas sensing

Cu3HHTP2 powders · Powder · PXRD patterns of Cu3HHTP2 powders reported in Supplementary Fig. 2.

Diffraction StructureUnspecified subtype

P-XRD

2025 · Proton Conductive Metal-Organic Framework Encapsulating Emissive Hexacyanidochromate(III) Ions for Ratiometric and Lifetime-Based Detection of Humidity and Temperature

air-stable 1a bulk polycrystalline powder · Powder · Powder X-ray diffraction patterns of 1, 1a, 1deh, 2a, 3a and 4a compared with calculated patterns.

Diffraction StructureSingle crystal

SC-XRD

2025 · Proton Conductive Metal-Organic Framework Encapsulating Emissive Hexacyanidochromate(III) Ions for Ratiometric and Lifetime-Based Detection of Humidity and Temperature

air-stable 1a bulk polycrystalline powder · Powder · Single-crystal X-ray diffraction on 1, 1a and 1deh; 100(2) K, Mo Kalpha, Bruker D8 Quest Eco.

Diffraction StructureSingle crystal

SC-XRD

2025 · Proton Conductive Metal-Organic Framework Encapsulating Emissive Hexacyanidochromate(III) Ions for Ratiometric and Lifetime-Based Detection of Humidity and Temperature

air-dried 3a bulk powder · Powder · Single-crystal X-ray diffraction on 2, 3 and 4; 100(2) K, Mo Kalpha.

Microscopy MorphologyUnspecified subtype

SEM and P-XRD after cycling

2025 · Proton Conductive Metal-Organic Framework Encapsulating Emissive Hexacyanidochromate(III) Ions for Ratiometric and Lifetime-Based Detection of Humidity and Temperature

air-stable 1a bulk polycrystalline powder · Powder · P-XRD patterns and SEM images before/after humidity and temperature optical measurements.

Diffraction StructureSingle crystal

SCXRD-derived bond lengths and angles

2025 · Proton-electron coupling and mixed conductivity in a hydrogen-bonded coordination polymer

Ni-BAND blue crystals · Single Crystal · Supplementary Data 1 reports selected bond lengths and angles for Ni-BAND.

Diffraction StructureSingle crystal

SCXRD hydrogen-bond contact analysis

2025 · Proton-electron coupling and mixed conductivity in a hydrogen-bonded coordination polymer

Ni-BAND blue crystals · Single Crystal · H-bond contacts satisfying Steiner criteria listed from crystal structure.

Diffraction StructurePowderGrazing incidence

Powder XRD and grazing-incidence XRD

2025 · Proton-electron coupling and mixed conductivity in a hydrogen-bonded coordination polymer

Ni-BAND thin film · Thin Film · PXRD compared with single-crystal simulated pattern; in-plane and out-of-plane GIXRD on thin films.

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2025 · Radiation-Induced in Situ Construction of 2D Conductive Defect-Rich Metal-Organic Frameworks for High-Performance Supercapacitor

Cu-CAT-Rad · Powder · Cu Kalpha PXRD; P6/m refinement

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2025 · Radiation-Induced in Situ Construction of 2D Conductive Defect-Rich Metal-Organic Frameworks for High-Performance Supercapacitor

Cu-CAT-Sol · Powder · Cu Kalpha PXRD; P6/m refinement

Diffraction StructurePowder

PXRD after immersion in ultrapure water

2025 · Rational Design of Conductive MOF-Based Diatomic Electrocatalysts for Selective Ammonia Synthesis

Cu99Ni1-DBCO · Powder · Cu99Ni1-DBCO immersed in aqueous solution/ultrapure water pH 6.8 for 3 months.

Diffraction StructurePowderRefinement

In situ PXRD under humid air/vacuum cycling with Le Bail refinement

2025 · Screening-Enabled Chemiresistive Moisture Sensing with Tetrathiafulvalene-Based Electrically Conductive Metal–Organic Frameworks

Ground M2(TTFTB) powders for in situ PXRD · Powder · PXRD in humid air (296-298 K, 40-45% RH), evacuation at 1e-2 mbar and 298 K for 1 h, then humid-air exposure for 1 h; repeated once.

Diffraction StructurePowder

Ex situ PXRD after humidity/thermal treatment

2025 · Screening-Enabled Chemiresistive Moisture Sensing with Tetrathiafulvalene-Based Electrically Conductive Metal–Organic Frameworks

Ground M2(TTFTB) powders for in situ PXRD · Powder · As-synthesised and treated samples compared to simulated PXRD patterns; includes 363 K and 90% RH for 72 h, and 85 deg C for 1 h.

Diffraction StructureSingle crystal

SC-XRD structural analysis and shortest S...S distance comparison

2025 · Screening-Enabled Chemiresistive Moisture Sensing with Tetrathiafulvalene-Based Electrically Conductive Metal–Organic Frameworks

Ground M2(TTFTB) powders for in situ PXRD · Powder · As-synthesised structures; Co and Mn measured at 100(2) K; Cd and Zn structural comparison included in Figure 6a.

Diffraction StructurePowderRefinement

Synchrotron PXRD with DFT-optimised model and Rietveld refinement

2025 · Selenium-Substitution Strategy for Enhanced Mobility, Tunable Bandgap, and Improved Electrochemical Energy Storage in Semiconducting Conjugated Coordination Polymers

Ag4TSHQ powder · Powder · High-resolution synchrotron powder XRD at SSRF BL14B1, lambda = 0.69003 Angstrom; Rietveld refinement in Jana2006 after DFT optimisation.

Diffraction StructurePowder

PXRD and SEM/element mapping for Ag4TXHQ series

2025 · Selenium-Substitution Strategy for Enhanced Mobility, Tunable Bandgap, and Improved Electrochemical Energy Storage in Semiconducting Conjugated Coordination Polymers

Ag4TXHQ-1:1 powder · Powder · PXRD and SEM/EDS maps for all mixed-ligand ratios.

Diffraction StructurePowder

powder X-ray diffraction (XRD)

2025 · Self-amplifying bimetallic conductive metal-organic framework for sensitive label-free electrochemiluminescence detection of aflatoxin B1

ZnCoMOFs black precipitate/powder · Powder · XRD pattern used to assign crystal-plane reflections of ZnCoMOFs

Diffraction StructurePowderRefinement

Powder XRD with Rietveld refinement

2025 · Semiconducting Manganese-Bipyridyl Coordination Polymer via a Manganese-Metal-Nanoparticle Approach

As-prepared 1 containing residual NaCl · Powder · Powder sample of 1 mortared with equal amount of amorphous glass spheres; measured in 0.4 mm glass capillary with Cu-Kalpha radiation; Rietveld refinement used single-crystal CIF data as structural model.

Diffraction StructurePowderSingle crystalRefinement

Single-crystal X-ray diffraction; powder XRD with Rietveld refinement

2025 · Semiconducting Manganese-Bipyridyl Coordination Polymer via a Manganese-Metal-Nanoparticle Approach

Black-red shiny metallic crystals of 1 · Single Crystal · Single-crystal structure analysis assigned space group and chain/interpenetration structure; powder XRD with Rietveld refinement confirmed composition and structure.

OtherUnspecified subtype

Thermogravimetry and XRD of thermal remnant

2025 · Semiconducting Manganese-Bipyridyl Coordination Polymer via a Manganese-Metal-Nanoparticle Approach

Manually separated/rinsed crystals of 1 · Single Crystal · Crystals of 1 manually separated and rinsed with toluene; TG measured under dried air up to 1200 deg C at 5 K/min in corundum crucible; XRD used to identify remnant.

Diffraction StructurePowder

powder X-ray diffraction

2025 · Solvent-Directed Assembly of π-Stacked 3D Metal-Organic Frameworks with Tunable Conductivity Enhanced by C60 Encapsulation

NU-4003 · Single Crystal · PXRD compared with simulated patterns for phase purity of NU-4000-NU-4003 and NU-4003-C60

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2025 · Solvent-Directed Assembly of π-Stacked 3D Metal-Organic Frameworks with Tunable Conductivity Enhanced by C60 Encapsulation

NU-4000 · Single Crystal · 100 K under nitrogen cryostream; structures solved with SHELXT and refined with SHELXL/Olex2

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2025 · Solvent-Directed Assembly of π-Stacked 3D Metal-Organic Frameworks with Tunable Conductivity Enhanced by C60 Encapsulation

NU-4001 · Single Crystal · 100 K under nitrogen cryostream; structures solved with SHELXT and refined with SHELXL/Olex2

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2025 · Solvent-Directed Assembly of π-Stacked 3D Metal-Organic Frameworks with Tunable Conductivity Enhanced by C60 Encapsulation

NU-4002 · Single Crystal · 100 K under nitrogen cryostream; structures solved with SHELXT and refined with SHELXL/Olex2

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2025 · Solvent-Directed Assembly of π-Stacked 3D Metal-Organic Frameworks with Tunable Conductivity Enhanced by C60 Encapsulation

NU-4003 · Single Crystal · 100 K under nitrogen cryostream; structures solved with SHELXT and refined with SHELXL/Olex2

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2025 · Stacking growth of ionically conductive MOF on biofabrics enables reliable NH3 sensor for hepatic encephalopathy diagnosis

Zn-TCPP-6 sensor on alginate fabric · Thin Film · Crystal structure of Zn-TCPP and Zn-HHTP.

Diffraction StructurePowderRefinement

Le Bail refinement of PXRD

2025 · Structural Control of Photoconductivity in a Flexible Titanium-Organic Framework

MUV-35-c closed phase · Single Crystal

Diffraction StructurePowder

powder X-ray diffraction

2025 · Structural Control of Photoconductivity in a Flexible Titanium-Organic Framework

as-made MUV-35 crystals · Single Crystal

Diffraction StructurePowder

PXRD

2025 · Structure-directing effect of terephthalate in bridging Zn(ii)- and Cd(ii)-based coordination polymers towards application in the detection of trace quantities of Pd2+ in aqueous media and their electrical conductivities

CP1 as-synthesised block-shaped yellow crystals · Single Crystal · As-synthesised CP1 compared with simulated pattern; water/Pd2+ and pH-stability PXRD also reported in SI figures.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2025 · Structure-directing effect of terephthalate in bridging Zn(ii)- and Cd(ii)-based coordination polymers towards application in the detection of trace quantities of Pd2+ in aqueous media and their electrical conductivities

CP1 as-synthesised block-shaped yellow crystals · Single Crystal · Crystal selected from solution, dipped in oil, mounted on goniometer; Mo Kalpha radiation lambda = 0.71073 A at 273 K; SHELXT/SHELXL/Olex2 refinement.

Diffraction StructurePowder

PXRD

2025 · Structure-directing effect of terephthalate in bridging Zn(ii)- and Cd(ii)-based coordination polymers towards application in the detection of trace quantities of Pd2+ in aqueous media and their electrical conductivities

CP2 as-synthesised yellow needle-like crystals · Single Crystal · As-synthesised CP2 compared with simulated pattern; water/Pd2+ and pH-stability PXRD also reported in SI figures.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2025 · Structure-directing effect of terephthalate in bridging Zn(ii)- and Cd(ii)-based coordination polymers towards application in the detection of trace quantities of Pd2+ in aqueous media and their electrical conductivities

CP2 as-synthesised yellow needle-like crystals · Single Crystal · Crystal selected from solution, dipped in oil, mounted on goniometer; Cu Kalpha radiation lambda = 1.54184 A reported in SI table at 273 K; SHELXT/SHELXL/Olex2 refinement.

Diffraction StructurePowder

PXRD/XRD

2025 · Superhydrophilic hydrogel-enhanced conductive MOF-based wearable sweat sensors with anti-lipid biofouling capability

Ni-HAB MOF powder · Powder · X-ray diffraction pattern compared with simulated Ni-HAB pattern.

Diffraction StructureUnspecified subtype

XRD and SAED

2025 · Tuning the dxy Orbital Energy Level in 2D Cobalt-Organic-Framework via in-Plane Conjugated Phthalocyanine for Self-Powered Sensing

2D MOF nanosheets · Nanosheet · Powder XRD peaks and SAED rings for 2D MOF and 2D MOF@Pc.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Tuning the Electrical Conductivity of Bimetallic Co–Mn-Based MOFs via Precisely Regulating the Atomic Content of Metal Centers and Study on Their Dye Adsorption Properties

As-synthesised MOF1-MOF9 bulk series · Powder · Bruker D8 Advance A25, Cu K-alpha radiation, 2theta 5-80 deg; PXRD spectra collected for MOF series.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2025 · Tuning the Electrical Conductivity of Bimetallic Co–Mn-Based MOFs via Precisely Regulating the Atomic Content of Metal Centers and Study on Their Dye Adsorption Properties

As-synthesised MOF2 · Powder · Agilent SuperNova E, Mo source; only MOF2 and MOF3 crystals suitable for SCXRD.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction refinement

2025 · Tuning the Electrical Conductivity of Bimetallic Co–Mn-Based MOFs via Precisely Regulating the Atomic Content of Metal Centers and Study on Their Dye Adsorption Properties

As-synthesised MOF2 · Powder · SI Table S1 reports MOF2 unit-cell and refinement parameters; Mo source wavelength 0.71073 A, T = 296(2) K.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction cell/reflection summary

2025 · Tuning the Electrical Conductivity of Bimetallic Co–Mn-Based MOFs via Precisely Regulating the Atomic Content of Metal Centers and Study on Their Dye Adsorption Properties

As-synthesised MOF3 · Powder · SI Table S1 reports MOF3 cell/reflection parameters; Mo source wavelength 0.71073 A.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2025 · Tuning the Structure-Property Relationships of Metallophthalocyanine-Based Two-Dimensional Conductive Metal-Organic Frameworks with Different Metal Linkages

CuPc-O-Cu black powder · Powder · Rigaku MiniFlex Cu Kalpha, 2theta 3-40 deg, scan rate 1 deg min-1; compared to simulated stacking models.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2025 · Tuning the Structure-Property Relationships of Metallophthalocyanine-Based Two-Dimensional Conductive Metal-Organic Frameworks with Different Metal Linkages

CuPc-O-Ni black powder · Powder · Rigaku MiniFlex Cu Kalpha, 2theta 3-40 deg, scan rate 1 deg min-1; compared to simulated stacking models.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2025 · Tuning the Structure-Property Relationships of Metallophthalocyanine-Based Two-Dimensional Conductive Metal-Organic Frameworks with Different Metal Linkages

CuPc-O-Zn black powder · Powder · Rigaku MiniFlex Cu Kalpha, 2theta 3-40 deg, scan rate 1 deg min-1; compared to simulated stacking models.

Diffraction StructurePowder

PXRD [100] reflection FWHM

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Cu-1EG pristine powder · Powder · full-width-at-half-maximum of [100] peak near 3.7 deg

Diffraction StructurePowder

PXRD [100] reflection FWHM

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Cu-2EG pristine powder · Powder · full-width-at-half-maximum of [100] peak near 3.7 deg

Diffraction StructurePowder

PXRD [100] reflection FWHM

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Cu-nBu pristine powder · Powder · full-width-at-half-maximum of [100] peak near 3.7 deg

Diffraction StructurePowder

PXRD [100] reflection FWHM

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Ni-1EG pristine powder · Powder · full-width-at-half-maximum of [100] peak near 3.7 deg

Diffraction StructurePowder

PXRD [100] reflection FWHM

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Ni-2EG pristine powder · Powder · full-width-at-half-maximum of [100] peak near 3.7 deg

Diffraction StructurePowder

PXRD [100] reflection FWHM

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Ni-nBu pristine powder · Powder · full-width-at-half-maximum of [100] peak near 3.7 deg

Diffraction StructurePowder

PXRD [001] reflection analysis

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Cu-1EG pristine powder · Powder · interlayer c-c distance from [001] reflection in 2theta 23-28 deg region

Diffraction StructurePowder

PXRD [001] reflection analysis

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Cu-2EG pristine powder · Powder · interlayer c-c distance from [001] reflection in 2theta 23-28 deg region

Diffraction StructurePowder

PXRD [001] reflection analysis

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Cu-nBu pristine powder · Powder · interlayer c-c distance from [001] reflection in 2theta 23-28 deg region

Diffraction StructurePowder

PXRD [001] reflection analysis

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Ni-1EG pristine powder · Powder · interlayer c-c distance from [001] reflection in 2theta 23-28 deg region

Diffraction StructurePowder

PXRD [001] reflection analysis

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Ni-2EG pristine powder · Powder · interlayer c-c distance from [001] reflection in 2theta 23-28 deg region

Diffraction StructurePowder

PXRD [001] reflection analysis

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Ni-nBu pristine powder · Powder · interlayer c-c distance from [001] reflection in 2theta 23-28 deg region

Diffraction StructurePowder

variable-temperature PXRD

2025 · Turning 2D MOFs into Mixed Ionic-Electronic Conductors via Side Chain Engineering

Ni-1EG pristine powder · Powder · ambient air thermal stability assessment

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2025 · Two dimensional Conjugated Metal–Organic Frameworks with Multiple Redox-Active Sites towards High-Performance Sodium-Ion Battery

Cu-DDQP black powder · Powder · PXRD experimental/refined/calculated patterns in Figure 2b.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2025 · Two dimensional Conjugated Metal–Organic Frameworks with Multiple Redox-Active Sites towards High-Performance Sodium-Ion Battery

Cu-TBPQ black powder · Powder · PXRD experimental/refined/calculated patterns in Figure 2a.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2025 · Two dimensional Conjugated Metal–Organic Frameworks with Multiple Redox-Active Sites towards High-Performance Sodium-Ion Battery

Cu-TTPQ black powder · Powder · PXRD compared with simulated stacking models; Cu target tube.

Diffraction StructurePowder

solvent stability PXRD

2025 · Two dimensional Conjugated Metal–Organic Frameworks with Multiple Redox-Active Sites towards High-Performance Sodium-Ion Battery

Cu-TTPQ black powder · Powder · Cu-TTPQ immersed in H2O, THF, acetone, DMF, 1 M AcOH and 1 M NaOH for five days; PXRD after exposure.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Two-dimensional conductive metal-organic framework with 2,3,6,7,14,15-triptycenehexathiol (TCHT) ligand: synthesis, structure, electrical conductivity and CO2RR activity

Cu-TCHT black powder · Powder · Rigaku SmartLab Studio II; Cu Kalpha lambda 1.5405 A; 2theta range 2-50 deg; 1 deg/min and 0.02 deg/step.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2025 · Two-dimensional conductive metal-organic framework with 2,3,6,7,14,15-triptycenehexathiol (TCHT) ligand: synthesis, structure, electrical conductivity and CO2RR activity

HMTTC precursor · Powder · Rigaku XtaLAB AFC10; Mo Kalpha radiation; 120 K.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2025 · Two-dimensional conductive metal-organic framework with 2,3,6,7,14,15-triptycenehexathiol (TCHT) ligand: synthesis, structure, electrical conductivity and CO2RR activity

TCHT ligand powder/single crystal · Powder · Rigaku XtaLAB AFC10; HyPix-6000HE detector; Mo Kalpha lambda 0.7107 A; cryogenic equipment GN-2D/S.

SpectroscopyUnspecified subtype

FT-IR, Raman and XRD

2025 · Two-Dimensional π-d Conjugated Conductive Metal-Organic Framework with Triple Active Centers as High-Performance Cathodes for Flexible Zinc Batteries

Pristine 1D Cu-TABQ powder · Powder · Powder characterisation of 1D Cu-TABQ for comparison with 2D Cu-TABQ.

Diffraction StructureUnspecified subtype

Post-water-splitting SEM/XPS/XRD

2025 · Ultrathin 2D metal-organic framework nanosheet arrays to boost the overall efficiency of water splitting

TIT-1@NS/NF · Electrode · Post-test surface morphology, binding energies and phase integrity checks.

Diffraction StructurePowder

Powder X-ray diffraction

2025 · Ultrathin 2D metal-organic framework nanosheet arrays to boost the overall efficiency of water splitting

TIT-1@NS · Nanosheet · PXRD patterns of TIT-1, TIT-1@NS and TIT-1@NS after water splitting; compared with simulated TIT-1.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2025 · Ultrathin 2D metal-organic framework nanosheet arrays to boost the overall efficiency of water splitting

TIT-1 · Powder · Crystal structure determination; crystal data and selected bond lengths/angles reported in rendered SI Table S1 and Table S2.

OtherPowder

Thermogravimetric analysis and temperature-dependent PXRD.

2025 · Uninterrupted π-d Conjugated Three-Dimensional Conductive Metal-Organic Framework

As-synthesised Ni3HBC greenish-black nanocrystalline powder · Powder · TGA under airflow of 40 mL min-1 from 25 to 700 deg C at 5 deg C min-1; PXRD after heating under vacuum at RT, 60, 80, 100 and 150 deg C for 2 h each.

Diffraction StructurePowder

Powder X-ray diffraction (Cu K-alpha)

2025 · Unraveling the Electrical, Dielectric, and Electrocatalytic Properties of Bimetallic Cobalt-Based Metal–Organic Frameworks

Co-BTC cold-pressed pellet · Pellet · 5-50 degrees 2theta, scan rate 0.5 degrees min^-1.

Diffraction StructurePowder

Powder X-ray diffraction (Cu K-alpha)

2025 · Unraveling the Electrical, Dielectric, and Electrocatalytic Properties of Bimetallic Cobalt-Based Metal–Organic Frameworks

Mn-BTC cold-pressed pellet · Pellet · 5-50 degrees 2theta, scan rate 0.5 degrees min^-1.

Diffraction StructurePowder

Powder X-ray diffraction (Cu K-alpha)

2025 · Unraveling the Electrical, Dielectric, and Electrocatalytic Properties of Bimetallic Cobalt-Based Metal–Organic Frameworks

1:2 Mn:Co cold-pressed pellet · Pellet · Bimetallic 1:2, 1:1, and 2:1 Mn:Co pellets compared with pure Mn-BTC and Co-BTC.

Diffraction StructureGrazing incidence

GIWAXS at DESY beamline P08

2025 · Unveiling high-mobility hot carriers in a two-dimensional conjugated coordination polymer

large-area Cu3BHT film on fused silica · Thin Film · 18 keV beam; 100 um vertical x 400 um horizontal beam size; 0.1 deg grazing incidence; 30 s exposure; WxDiff analysis.

Diffraction StructureGrazing incidenceWide / small angle scattering

GI-WAXS

2025 · Volatolomics in Fritillarias and Their Identification by Orientation Controlled cMOF Thin Film Chemiresistors

Cu-HHTP[100]-20C thin film · Thin Film · GI-WAXS comparison of Cu-HHTP[100] and Cu-HHTP[001] films.

Diffraction StructureUnspecified subtype

out-of-plane and in-plane XRD

2025 · Volatolomics in Fritillarias and Their Identification by Orientation Controlled cMOF Thin Film Chemiresistors

Cu-HHTP[001]-20C thin film · Thin Film · XRD patterns collected for Cu-HHTP[100] and Cu-HHTP[001] films.

Diffraction StructurePowder

PXRD profile fitting with simulated structures

2024 · 2D Conductive Metal-Organic Frameworks Based on Tetraoxa[8]circulenes as Promising Cathode for Aqueous Zinc Ion Batteries

Cu-TOC black powder / pressed pellet · Powder · Powder X-ray diffraction patterns combined with theoretical simulation; profile fitting by Le Bail algorithm in SI.

Computational ModellingPowder

DFT geometry optimisation in VASP with PBE and PXRD simulation/profile fitting

2024 · 2D Conductive Metal-Organic Frameworks Based on Tetraoxa[8]circulenes as Promising Cathode for Aqueous Zinc Ion Batteries

Cu-TOC black powder / pressed pellet · Powder · 2D monolayers linked by 8OH-TOC and metal nodes; 1.5 nm interlayer distance for monolayers; 550 eV cutoff; 2x2x1 Monkhorst-Pack mesh; AA, AA prime and AB stacked models compared with experimental PXRD.

Electrochemistry ApplicationPowder

ex situ PXRD and XPS at selected charge/discharge states

2024 · 2D Conductive Metal-Organic Frameworks Based on Tetraoxa[8]circulenes as Promising Cathode for Aqueous Zinc Ion Batteries

Cu-TOC cathode electrode · Electrode · Ex situ XRD/XPS at selected states of the second charge/discharge process, 50 mA g-1.

Diffraction StructurePowder

variable-temperature PXRD and solvent-soaking PXRD

2024 · 2D Conductive Metal-Organic Frameworks Based on Tetraoxa[8]circulenes as Promising Cathode for Aqueous Zinc Ion Batteries

Cu-TOC black powder / pressed pellet · Powder · PXRD collected at different temperatures and after soaking 3 days in DMF, DCM, THF, methanol, acetonitrile and water.

Diffraction StructurePowder

PXRD profile fitting with simulated structures

2024 · 2D Conductive Metal-Organic Frameworks Based on Tetraoxa[8]circulenes as Promising Cathode for Aqueous Zinc Ion Batteries

Mn-TOC black powder / pressed pellet · Powder · Powder X-ray diffraction patterns combined with theoretical simulation; profile fitting by Le Bail algorithm in SI.

Diffraction StructurePowder

PXRD profile fitting with simulated structures

2024 · 2D Conductive Metal-Organic Frameworks Based on Tetraoxa[8]circulenes as Promising Cathode for Aqueous Zinc Ion Batteries

Zn-TOC black powder / pressed pellet · Powder · Powder X-ray diffraction patterns combined with theoretical simulation; profile fitting by Le Bail algorithm in SI.

Diffraction StructurePowder

PXRD before and after NFZ photocatalysis

2024 · 4′-((4-cyanobenzyl)oxy)-[1,1′-biphenyl] -4-carboxylic acid based Cd(II), Co(II), Mn(II) and Ni(II) coordination polymers as photocatalyst for nitrofurazone degradation

CP 1 yellow block crystals · Single Crystal · CP 1 PXRD compared before synthesis/use and after photocatalysis; SI Figure S2 shows simulated, synthesized, and after-photodegradation traces.

Diffraction StructurePowder

PXRD before and after NFZ photocatalysis

2024 · 4′-((4-cyanobenzyl)oxy)-[1,1′-biphenyl] -4-carboxylic acid based Cd(II), Co(II), Mn(II) and Ni(II) coordination polymers as photocatalyst for nitrofurazone degradation

CP 2 purple block crystals · Single Crystal · CP 2 PXRD compared before synthesis/use and after photocatalysis; SI Figure S2 shows simulated, synthesized, and after-photodegradation traces.

Diffraction StructurePowder

PXRD before and after NFZ photocatalysis

2024 · 4′-((4-cyanobenzyl)oxy)-[1,1′-biphenyl] -4-carboxylic acid based Cd(II), Co(II), Mn(II) and Ni(II) coordination polymers as photocatalyst for nitrofurazone degradation

CP 3 pink block crystals · Single Crystal · CP 3 PXRD compared before synthesis/use and after photocatalysis; SI Figure S2 shows simulated, synthesized, and after-photodegradation traces.

Diffraction StructurePowder

Photocatalyst recycling followed by PXRD before/after fourth cycle

2024 · 4′-((4-cyanobenzyl)oxy)-[1,1′-biphenyl] -4-carboxylic acid based Cd(II), Co(II), Mn(II) and Ni(II) coordination polymers as photocatalyst for nitrofurazone degradation

CP 4 green block crystals · Single Crystal · CP 4 recovered after each photocatalytic cycle, washed repeatedly with double-distilled water, dried, reused for four total cycles; PXRD after fourth cycle.

Diffraction StructurePowder

powder XRD

2024 · A Computation-Guided Design of Highly Defined and Dense Bimetallic Active Sites on a Two-Dimensional Conductive Metal–Organic Framework for Efficient H2O2 Electrosynthesis

Ni-TCPP(Co) nanosheets/crystals · Nanosheet · Cu Kalpha radiation; M2-TCPP(Co) analogue patterns

Diffraction StructurePowder

X-ray powder diffraction

2024 · A highly sensitive AgNPs/Ni3(HHTP)2 SERS substrate for the detection of food additives and pesticide residues

rod-shaped Ni3(HHTP)2 film · Thin Film · SmartLab 9KW powder diffractometer.

Diffraction StructurePowder

Powder XRD

2024 · A novel pencil graphite electrode modified with an iron-based conductive metal-organic framework exhibited good ability in simultaneous sensing bisphenol A and bisphenol S

Fe-HHTP powder · Powder · Ultima IV, 40 keV, 40 mA, scan rate 4.0, increment 0.02 deg from 5 to 70 deg 2theta, nickel-filtered Cu Ka radiation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2024 · A Sensing Platform Based on Ni/Mn Bimetal-Organic Framework for Electrochemical Detection of Osimertinib

green Ni/Mn-MOF powder · Powder · Philips X'pert diffractometer with Cu K alpha radiation, lambda = 1.54059 A.

Diffraction StructurePowder

PXRD with simulated XRD comparison; SAED plane assignment

2024 · A Triptycene-Based Layered/Flower-Like 2D Conductive Metal–Organic Framework with 3D Extension as an Electrode for Efficient Li Storage

Pristine M-DBH powders (M = Ni, Co, Mn) · Powder · Room-temperature PXRD; simulated AB-staggered stacking compared with experimental patterns.

SpectroscopyPowder

N K-edge soft XAS and PXRD of acid-solution reprecipitates

2024 · Acid-Dependent Charge Transport in a Solution-Processed 2D Conductive Metal-Organic Framework

Reprecipitated Cu3(HHTATP)2 from DMSO/TFA solution · Powder · Cu3(HHTATP)2 dispersed in DMSO/TFA, reprecipitated, then washed with acetone, reagent alcohol, or 0.1 M Et3N/THF.

Diffraction StructureGrazing incidence

AFM and GIWAXS of spin-coated films

2024 · Acid-Dependent Charge Transport in a Solution-Processed 2D Conductive Metal-Organic Framework

Cu3(HHTATP)2 proton-doped spin-coated thin film · Thin Film · AFM on razorblade-scratched film; GIWAXS at PAL 3C with 9.3 keV photon energy and Eiger4M detector.

OtherPowder

Thermogravimetric analysis and heat-treatment PXRD

2024 · Acid-Dependent Charge Transport in a Solution-Processed 2D Conductive Metal-Organic Framework

Cu3(HHTATP)2 stacked nanoflake powder · Powder · TGA from 25 to 500 C at 5 C min^-1 under 40 mL min^-1 air; PXRD after 24 h oven heating at denoted temperatures.

Diffraction StructurePowderRefinement

Powder X-ray diffraction and Rietveld refinement

2024 · Aliovalent Substitution Tunes Physical Properties in a Conductive Bis(dithiolene) Two-Dimensional Metal-Organic Framework

Ni3(THT)2 black powder · Powder · Laboratory PXRD on Rigaku MiniFlex with Cu Kalpha; Bragg-Brentano reflection geometry; GSAS-II refinement over 3-33 degrees

Diffraction StructurePowder

PXRD after air or water exposure

2024 · Aliovalent Substitution Tunes Physical Properties in a Conductive Bis(dithiolene) Two-Dimensional Metal-Organic Framework

Ni3(THT)2 black powder · Powder · Ni3(THT)2 and Fe3(THT)2 under aerobic atmosphere or soaking in water for two weeks

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2024 · An Enzyme-Encapsulated Metal-Organic Frameworks Nanomesh Biosensor for Salivary Glucose Detection

CNT/GOx@ZIF-8 nanomesh · Powder · XRD patterns characterised using Rigaku MiniFlex600; compared with simulated CNT and ZIF-8 patterns.

Diffraction StructurePowder

PXRD

2024 · Aptasensor based on gold nanostructure-decorated 2D Cu metal–organic framework nanosheets for highly sensitive and specific electrochemical lipopolysaccharide detection

Cu-TCPP nanosheets · Nanosheet · PANalytical Empyrean diffractometer with Cu-Kalpha radiation, lambda = 0.15405 nm; Cu-TCPP and Cu-THQ compared with literature patterns.

OtherUnspecified subtype

Photocatalytic cycling stability with post-cycle XRD/FESEM/XPS

2024 · Bimetallic synergy significantly enhances the photocatalytic performance of lanthanide porphyrin-based MOFs: Efficient photocatalytic oxidation of benzyl alcohol and benzylamine under mild conditions in air

Ni-Nd PMOFs · Powder · Five photocatalytic cycles for benzyl alcohol and benzylamine; post-cycle XRD, FESEM, and XPS in SI.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2024 · Bimetallic synergy significantly enhances the photocatalytic performance of lanthanide porphyrin-based MOFs: Efficient photocatalytic oxidation of benzyl alcohol and benzylamine under mild conditions in air

Ni-Nd PMOFs · Powder · Xtalab Proll single-crystal diffractometer with Cu Kalpha radiation; Table S1 crystal data.

Diffraction StructurePowder

Powder X-ray diffraction

2024 · Bimetallic synergy significantly enhances the photocatalytic performance of lanthanide porphyrin-based MOFs: Efficient photocatalytic oxidation of benzyl alcohol and benzylamine under mild conditions in air

All reported TCPP/PMOF samples · Unknown · Powder XRD comparison of Ni-Nd PMOFs and Co-Nd PMOFs.

Diffraction StructurePowder

Powder X-ray diffraction

2024 · Bimetallic synergy significantly enhances the photocatalytic performance of lanthanide porphyrin-based MOFs: Efficient photocatalytic oxidation of benzyl alcohol and benzylamine under mild conditions in air

Nd PMOFs · Powder · PANalytical XRD, Cu Kalpha radiation, 40 kV, 300 mA, 2theta = 5-50 deg.

Diffraction StructurePowder

Powder X-ray diffraction

2024 · Carbon quantum dot-mediated binary metal-organic framework nanosheets for efficient oxygen evolution at ampere-level current densities in proton exchange membrane electrolyzers

NiFe-MOF-CQD · Nanosheet · XRD patterns of NiFe-MOF, NiFe-MOF-CQD and CQD supporting pattern.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Chromone-Based Cd(II) Fluorescent Coordination Polymer Fabricated to Study Optoelectronic and Explosive Sensing Properties

Complex 1 light-yellow X-ray-quality crystals · Single Crystal · PXRD patterns of complexes 1-4 compared with theoretical patterns from CIF files.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2024 · Conductive Metal-Organic Framework with Superior Redox Activity as a Stable High-Capacity Anode for High-Temperature K-Ion Batteries

bulk HAN-Cu-MOF powder · Powder · Cu Kalpha irradiation; AA stacking model; P6/MMM space group

Diffraction StructureUnspecified subtype

Ex situ XRD after discharge at varied humidity

2024 · Conductive Metal−Organic Frameworks for Rechargeable LiOH-Based Li−O2 Batteries

comparative M-HHTP and KB cathode set · Electrode · M-HHTP cathodes after discharge in humid O2 RH about 47%, dry O2, and air RH about 70%.

Diffraction StructureUnspecified subtype

Ex situ XRD and SEM after discharge and recharge

2024 · Conductive Metal−Organic Frameworks for Rechargeable LiOH-Based Li−O2 Batteries

comparative M-HHTP and KB cathode set · Electrode · Cathodes after discharge/recharge in humid environment, RH about 65%.

Diffraction StructureUnspecified subtype

XRD with Cu Kalpha radiation

2024 · Conductive Metal−Organic Frameworks for Rechargeable LiOH-Based Li−O2 Batteries

comparative M-HHTP powder set · Powder · As-synthesised M-HHTP catalyst powders.

Diffraction StructurePowderRefinement

Synchrotron PXRD with Rietveld refinement

2024 · Control of the Hydroquinone/Benzoquinone Redox State in High-Mobility Semiconducting Conjugated Coordination Polymers

as-synthesised Ag4TTBQ black solid/nanocrystalline film product · Powder · Debye-Scherrer transmission geometry; SSRF BL14B1; wavelength 0.69003 Angstrom; 2theta range 3-43 degrees; Jana2006 refinement.

Diffraction StructurePowderRefinement

Synchrotron PXRD with Rietveld refinement

2024 · Control of the Hydroquinone/Benzoquinone Redox State in High-Mobility Semiconducting Conjugated Coordination Polymers

as-synthesised Ag4TTHQ dark red/dark brown powder · Powder · Debye-Scherrer transmission geometry; SSRF BL14B1; wavelength 0.69003 Angstrom; 2theta range 3-43 degrees; Jana2006 refinement.

Diffraction StructurePowder

IR spectroscopy and PXRD control characterisation

2024 · Control of the Hydroquinone/Benzoquinone Redox State in High-Mobility Semiconducting Conjugated Coordination Polymers

AgNO3 plus TTHQ one-pot methanol control product · Powder · IR compared with Ag4TTBQ and Ag4TTHQ; PXRD compared with Ag4TTHQ.

Diffraction StructureGrazing incidence

XRD and GIWAXS

2024 · Controlling Film Formation and Host-Guest Interactions to Enhance the Thermoelectric Properties of Nickel-Nitrogen-Based 2D Conjugated Coordination Polymers

as-synthesised Ni-HAB film · Thin Film · Diffraction characterisation of Ni-N-based cCP films, including Ni-HAB, Ni-HATP, and Ni-HATI-H.

Diffraction StructurePowder

powder X-ray diffraction (XRD)

2024 · Copper-doped strontium metal-organic framework: Dual-function active material for supercapacitor and oxygen evolution reaction

Cu-doped Sr MOF powder · Powder · Rigaku MiniFlex II, Cu-Kalpha radiation, wavelength 0.15406 nm, 5-80 deg 2theta, 1 deg min-1 scan rate.

Diffraction StructurePowder

powder X-ray diffraction (XRD)

2024 · Copper-doped strontium metal-organic framework: Dual-function active material for supercapacitor and oxygen evolution reaction

Undoped Sr MOF powder · Powder · Rigaku MiniFlex II, Cu-Kalpha radiation, wavelength 0.15406 nm, 5-80 deg 2theta, 1 deg min-1 scan rate.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2024 · Cu/Fe-MOFs based on mixed ligands: Synthesis, crystal structure and electrocatalytic hydrogen evolution performance

Cu-MOF single crystals · Single Crystal · Main-text crystallographic data for Cu-MOF at 150 K; CCDC 2325549; monoclinic C2/c.

Diffraction StructurePowder

powder X-ray diffraction

2024 · Cu/Fe-MOFs based on mixed ligands: Synthesis, crystal structure and electrocatalytic hydrogen evolution performance

Fe-MOF single crystals · Single Crystal · As-prepared Fe-MOF powder XRD compared with simulated pattern from single-crystal XRD.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2024 · Cu/Fe-MOFs based on mixed ligands: Synthesis, crystal structure and electrocatalytic hydrogen evolution performance

Fe-MOF single crystals · Single Crystal · Main-text crystallographic data for Fe-MOF; CCDC 2325550; triclinic P-1.

Diffraction StructurePowder

powder X-ray diffraction

2024 · Cu/Fe-MOFs based on mixed ligands: Synthesis, crystal structure and electrocatalytic hydrogen evolution performance

Cu-MOF single crystals · Single Crystal · As-prepared Cu-MOF powder XRD compared with simulated pattern from single-crystal XRD.

Diffraction StructurePowder

PXRD after solvent immersion

2024 · De Novo Design and Facile Synthesis of Highly Crystalline 2D Conductive Metal-Organic Frameworks: A “Rotor-Stator” Strategy

Cu-DCB-MOF black powder · Powder · MOFs immersed in DMF, DMSO, DCM, CHCl3, 1,4-dioxane, THF and methanol at room temperature for 3 days.

Diffraction StructurePowderRefinement

PXRD Pawley refinement

2024 · De Novo Design and Facile Synthesis of Highly Crystalline 2D Conductive Metal-Organic Frameworks: A “Rotor-Stator” Strategy

Cu-DCB-MOF black powder · Powder · SmartLab diffractometer, pure Cu Kalpha1 radiation, capillary transmission mode, 5-50 deg, 0.01 deg step, 7.5 h counting.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2024 · Detection of Ascorbic Acid by Two-Dimensional Conductive Metal-Organic Framework-Based Electrochemical Sensors

as-synthesised Cu3(HHTP)2 powder · Powder · Pattern compared with simulated Cu3(HHTP)2 and reported characterisation.

Diffraction StructureUnspecified subtype

thin-film X-ray diffraction

2024 · Diffusional Electron Transport Coupled to Thermodynamically Driven Electron Transfers in Redox-Conductive Multivariate Metal-Organic Frameworks

Zn(NDI) thin film on FTO · Thin Film · Experimental thin-film XRD compared with simulated powder XRD; preferred orientation assessed.

Diffraction StructureUnspecified subtype

thin-film X-ray diffraction

2024 · Diffusional Electron Transport Coupled to Thermodynamically Driven Electron Transfers in Redox-Conductive Multivariate Metal-Organic Frameworks

Zn(NDI)0.2(PMDI)0.8 thin film on FTO · Thin Film · Experimental thin-film XRD compared with simulated powder XRD; preferred orientation assessed.

Diffraction StructureUnspecified subtype

thin-film X-ray diffraction

2024 · Diffusional Electron Transport Coupled to Thermodynamically Driven Electron Transfers in Redox-Conductive Multivariate Metal-Organic Frameworks

Zn(NDI)0.5(PMDI)0.5 thin film on FTO · Thin Film · Experimental thin-film XRD compared with simulated powder XRD; preferred orientation assessed.

Diffraction StructureUnspecified subtype

thin-film X-ray diffraction

2024 · Diffusional Electron Transport Coupled to Thermodynamically Driven Electron Transfers in Redox-Conductive Multivariate Metal-Organic Frameworks

Zn(NDI)0.8(PMDI)0.2 thin film on FTO · Thin Film · Experimental thin-film XRD compared with simulated powder XRD; preferred orientation assessed.

Diffraction StructureUnspecified subtype

thin-film X-ray diffraction

2024 · Diffusional Electron Transport Coupled to Thermodynamically Driven Electron Transfers in Redox-Conductive Multivariate Metal-Organic Frameworks

Zn(PMDI) thin film on FTO · Thin Film · Experimental thin-film XRD compared with simulated powder XRD; preferred orientation assessed.

Diffraction StructurePowder

Powder X-ray diffraction on scratched electrodeposited films

2024 · Direct Electrodeposition of Electrically Conducting Ni3(HITP)2 MOF Nanostructures for Micro-Supercapacitor Integration

Optimised pulsed potentiostatic Ni3(HITP)2 film from MeOH-DMSO bath · Thin Film · PXRD patterns compared for simulated, chemical reference, potentiodynamic, aqueous potentiostatic, organic continuous and organic pulsed deposits.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Efficient oxygen evolution using conductive cobalt-based metal-organic framework

cobalt oxide control powder · Powder · Cobalt oxide control PXRD shown in Figure S1a; SI methods report Rigaku MiniFlex with Cu-Kalpha radiation, 2theta range 5-30 deg, though the rendered panel spans approximately 30-60 deg.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Efficient oxygen evolution using conductive cobalt-based metal-organic framework

as-synthesised Co-BTB MOF powder · Powder · Rigaku MiniFlex with Cu-Kalpha radiation; data acquired over 2theta = 5-30 deg; synthesised Co-BTB compared with simulated Co-MOF.

Diffraction StructurePowder

PXRD

2024 · Electrochemical Capacitance Traces with Interlayer Spacing in Two-dimensional Conductive Metal–Organic Frameworks

Bu-MOF as-synthesised powder · Powder · [001] reflections between 2theta = 23-28 degrees used for interlayer spacing; [100] reflection FWHM from SI table.

Diffraction StructurePowder

PXRD

2024 · Electrochemical Capacitance Traces with Interlayer Spacing in Two-dimensional Conductive Metal–Organic Frameworks

Et-MOF as-synthesised powder · Powder · [001] reflections between 2theta = 23-28 degrees used for interlayer spacing; [100] reflection FWHM from SI table.

Diffraction StructurePowder

PXRD

2024 · Electrochemical Capacitance Traces with Interlayer Spacing in Two-dimensional Conductive Metal–Organic Frameworks

H-MOF as-synthesised powder · Powder · [001] reflections between 2theta = 23-28 degrees used for interlayer spacing; [100] reflection FWHM from SI table.

Diffraction StructurePowder

PXRD

2024 · Electrochemical Capacitance Traces with Interlayer Spacing in Two-dimensional Conductive Metal–Organic Frameworks

Pent-MOF as-synthesised powder · Powder · [001] reflections between 2theta = 23-28 degrees used for interlayer spacing; [100] reflection FWHM from SI table.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2024 · Electrochemical investigation of copper 1D conductive polymer for hybrid supercapacitor applications

Cu-PDA-MOF blue crystals · Single Crystal · D8-QUEST diffractometer with graphite-monochromatic Mo-Kalpha radiation; direct method solution; APEX3 data collection; Mercury and WinGX graphics.

Diffraction StructureUnspecified subtype

Simulated XRD diffractogram

2024 · Electrochemical investigation of copper 1D conductive polymer for hybrid supercapacitor applications

Cu-PDA-MOF blue crystals · Single Crystal · Simulated XRD from the single-crystal structure.

Diffraction StructureUnspecified subtype

X-ray diffraction (Cu K-alpha, lambda = 1.5418 A)

2024 · Electrodeposition of Ni/Cu Bimetallic Conductive Metal–Organic Frameworks Electrocatalysts with Boosted Oxygen Reduction Activity for Zinc–Air Batteries

Ni2.1Cu0.9(HITP)2 film on carbon cloth · Electrode · XRD pattern of electrodeposited Ni2.1Cu0.9(HITP)2 film.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Electrosynthesis of a Nickel-Based Conductive Metal-Organic Framework with Controlled Morphology for Enhanced Capacitance

Ni-HHTP comparative sample set · Unknown · Detached electrosynthesised samples and solvothermal bulk compared with simulated/impurity references.

Diffraction StructureUnspecified subtype

X-ray diffraction, Cu K alpha 1.5408 A, Bruker

2024 · Embedding Pt in Ni-MOF/CdS organic-inorganic hybrid materials as electron channel to promote photogenerated carrier separation for enhanced photocatalytic hydrogen evolution under visible light

0.3 NPC · Powder · XRD pattern of NPC series compared with CdS standard card and Ni-MOF reference pattern.

Diffraction StructureUnspecified subtype

X-ray diffraction, Cu K alpha 1.5408 A, Bruker

2024 · Embedding Pt in Ni-MOF/CdS organic-inorganic hybrid materials as electron channel to promote photogenerated carrier separation for enhanced photocatalytic hydrogen evolution under visible light

CdS · Powder · Crystallographic structure of materials; Fig. S1 referenced but supplied SI unreadable.

Diffraction StructureUnspecified subtype

X-ray diffraction, Cu K alpha 1.5408 A, Bruker

2024 · Embedding Pt in Ni-MOF/CdS organic-inorganic hybrid materials as electron channel to promote photogenerated carrier separation for enhanced photocatalytic hydrogen evolution under visible light

Ni-MOF · Powder · Ni-MOF XRD pattern compared with previous reports; Fig. S1 referenced but supplied SI unreadable.

Diffraction StructureGrazing incidence

Grazing-incidence X-ray diffraction (GIXRD)

2024 · Engineering High-k Oxide/CuSCN Interface for p-Channel Thin-Film Transistors

AlOx/TEOS/CuSCN + THF stack · Thin Film · CuSCN films on AlOx, AlOx/MAA, and AlOx/TEOS with and without THF; 2theta range 10-70 deg, Cu Kalpha, incident angle 0.1 deg.

Diffraction StructureUnspecified subtype

XRD, FTIR, TGA

2024 · Enhancement of the performance of Ge–air batteries under high temperatures using conductive MOF-modified Ge anodes

Ni3(HITP)2 powder · Powder · Crystal/chemical/thermal characterisation of Ni3(HITP)2 powder.

SpectroscopyUnspecified subtype

XRD, Raman spectroscopy, and XPS

2024 · Enhancement of the performance of Ge–air batteries under high temperatures using conductive MOF-modified Ge anodes

Ge@Ni3(HITP)2 anode · Electrode · Composite-anode phase, 2D conjugated structure, elemental survey, and high-resolution Ni 2p/N 1s spectra.

Diffraction StructureUnspecified subtype

XRD (Bruker D8 ADVANCE)

2024 · Enhancing Proton Conductivity and Dimensional Stability of Nanofiber Proton Exchange Membranes through In Situ Growth of MOF-Modified PVDF Nanofibers

PVDF/UiO-66-NH2 NFM · Thin Film · UiO crystal structure characterised within 5-40 degree 2theta range

Diffraction StructureUnspecified subtype

XRD (Bruker D8 ADVANCE)

2024 · Enhancing Proton Conductivity and Dimensional Stability of Nanofiber Proton Exchange Membranes through In Situ Growth of MOF-Modified PVDF Nanofibers

PVDF/UiO-66-NH2-SO3H NFM · Thin Film · UiO crystal structure characterised within 5-40 degree 2theta range

Diffraction StructurePowder

PXRD / XRD

2024 · Fabrication of high-performance supercapacitor of surface-engineered ZIF-8 for energy storage applications

1-Ag@ZIF-8 · Powder · PXRD of Ag/ZIF-8 nanocomposite used to assess ZIF-8 and Ag phases.

Diffraction StructurePowder

PXRD / XRD

2024 · Fabrication of high-performance supercapacitor of surface-engineered ZIF-8 for energy storage applications

2-Ag@ZIF-8 · Powder · PXRD of higher-Ag Ag/ZIF-8 nanocomposite used to assess ZIF-8 and Ag phases.

Diffraction StructurePowder

PXRD / XRD

2024 · Fabrication of high-performance supercapacitor of surface-engineered ZIF-8 for energy storage applications

ZIF-8 · Powder · Powder X-ray diffraction pattern compared with reported ZIF-8 patterns.

Diffraction StructurePowder

Williamson-Hall analysis of PXRD data

2024 · Fabrication of nonlinear optical metal-organic framework dizinc tetraglycinate dihydrate with optical limiting applications

DZTGD single crystal · Single Crystal · W-H plot slope and intercept used to derive lattice strain and crystallite size

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · From insulator to semiconductor: effect of host-guest interactions on charge transport in M-MOF-74 metal-organic frameworks

Cu-MOF-74 powder · Powder · Rigaku SmartLab X-ray diffractometer with HyPix-3000 detector; continuous scan, goniometer in 2theta orientation; typical range 5<2theta<40 deg, 0.01 deg step, 5 deg min-1.

Diffraction StructurePowder

powder X-ray diffraction, Cu Kalpha

2024 · Gas-Induced Electrical and Magnetic Modulation of Two-Dimensional Conductive Metal–Organic Framework

pristine Cu3(C6O6)2 powder · Powder · pristine and 1% gas-exposed powders after 6 h exposure

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Glucose sensing performance of bimetallic MOFs CoFe-ZIF/CC for enzyme-free saliva sensor applications

Co0.95Fe0.05-ZIF/CC composite · Nanosheet · Bruker D8 Advance with Cu Kalpha radiation; compared CC, Co0.95Fe0.05-ZIF and Co0.95Fe0.05-ZIF/CC.

Diffraction StructurePowder

powder X-ray diffraction

2024 · High-Performance H2S Sensors to Detect SF6 Leakage

Co1.8Ni1.2(HITP)2 powder · Powder · XRD spectra for CoxNi3-x(HITP)2 compositions x = 0, 0.6, 1.2, 1.5, 1.8, 2.4 and 3.

Diffraction StructureUnspecified subtype

XRD

2024 · High-performance hybrid supercapacitors enabled by CoTe@CoFeTe double-shelled nanocubes

CoTe@CoFeTe · Powder · Phase composition of ZIF67, ZIF67@CoFe-PBA, Co3O4@CoFe2O4, and CoTe@CoFeTe.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2024 · High-Performance Ni3(HHTP)2 Film-Based Flexible Field-Effect Transistor Gas Sensors

Prepared Ni3(HHTP)2 material · Powder · XRD pattern of prepared Ni3(HHTP)2.

Diffraction StructurePowder

PXRD and SEM characterization of control cMOFs

2024 · Humidity-Mediated Dual Ionic-Electronic Conductivity Enables High Sensitivity in MOF Chemiresistors

M3HHTP2 and M3HITP2 control sensors · Electrode · PXRD spectra and SEM images for M3HHTP2 and M3HITP2 (M = Co, Ni, Cu).

Diffraction StructurePowder

Continuous humidity-dependent PXRD

2024 · Humidity-Mediated Dual Ionic-Electronic Conductivity Enables High Sensitivity in MOF Chemiresistors

Cu3HHTT2 powder · Powder · PANalytical Empyrean Mo Kalpha with Anton Paar CHC+ heating/humidity stage; powders pre-activated at 80 C under dry air; spectra after 90 min humidity saturation; scan speed 4.5 deg/min.

Diffraction StructurePowder

Laboratory powder X-ray diffraction

2024 · Humidity-Mediated Dual Ionic-Electronic Conductivity Enables High Sensitivity in MOF Chemiresistors

Cu3HHTT2 powder · Powder · Reflection mode Bruker Advance II with Ni-filtered Cu Kalpha radiation; sample on zero-background silicon substrate; scan speed 2 deg min-1.

SpectroscopyUnspecified subtype

Post-H2S XPS, Cu-AES, SEM-EDX, XRD, and FTIR

2024 · In Situ Growth of Conductive Metal-Organic Framework onto Cu2O for Highly Selective and Humidity-Independent Hydrogen Sulfide Detection in Food Quality Assessment

Cu2O@CuHHTP-3 interdigital electrode sensor · Electrode · Cu2O@CuHHTP exposed to 50 ppm H2S for 100 s at room temperature; powder scraped for immediate XPS testing.

Diffraction StructurePowder

Powder XRD using Cu K alpha radiation

2024 · In Situ Growth of Conductive Metal-Organic Framework onto Cu2O for Highly Selective and Humidity-Independent Hydrogen Sulfide Detection in Food Quality Assessment

Cu2O@CuHHTP-3 powder · Powder · Phase assignment for Cu2O and CuHHTP in Cu2O@CuHHTP-n series.

Diffraction StructureUnspecified subtype

X-ray diffraction (Ultima IV, Cu K alpha)

2024 · In-situ growth of electrically conductive MOFs in wood cellulose scaffold for flexible, robust and hydrophobic membranes with improved electrochemical performance

NiCAT powder · Powder · 20 kV, 30 mA; NiCAT powder compared with TOW membrane and 50%-NiCAT@TOW.

Diffraction StructureUnspecified subtype

X-ray diffraction (Ultima IV, Cu K alpha)

2024 · In-situ growth of electrically conductive MOFs in wood cellulose scaffold for flexible, robust and hydrophobic membranes with improved electrochemical performance

50%-NiCAT@TOW membrane · Thin Film · XRD pattern of 50%-NiCAT@TOW membrane used to confirm NiCAT integration with cellulose crystalline faces.

Diffraction StructurePowder

powder X-ray diffraction

2024 · Laccase-inspired bi-amino acid MOFs with high substrate affinity: Catalytic deposition induced “signal-down” electrochemical response towards PD-L1

Cu-F/Hs powder/nanoparticles · Powder · Cu-F/Hs XRD pattern compared with simulated Cu-F/Hs pattern after baseline correction and fitting.

Diffraction StructurePowder

PXRD before and after X-ray exposure

2024 · Large-Area Metal–Organic Framework Glasses for Efficient X-Ray Detection

Ag/ZnPIm/Ag planar MOF glass detector · Electrode · ZnPIm MOF glass measured before and after X-ray experiment.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Large-Area Metal–Organic Framework Glasses for Efficient X-Ray Detection

Dry ZnPIm powder · Powder · Freshly synthesised ZnPIm powder, glass and simulated patterns compared; Figure 2a corrected in 2026 correction.

Diffraction StructurePowder

Temperature-dependent PXRD

2024 · Large-Area Metal–Organic Framework Glasses for Efficient X-Ray Detection

Dry ZnPIm powder · Powder · Bruker D8 Advanced diffractometer with Anton Parr CHC plus non-ambient chamber; heating rate 5 C/min, isothermal scans.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2024 · Layered coordination polymer with two-dimensional covalent bismuth-organic networks: Semiconductor and lithium ion storage

as-made Bi-DSBDC-DMA yellow crystalline solid · Powder · Reflection mode at room temperature on Bruker D8 Advanced diffractometer using Cu-Kalpha radiation, 40 kV and 25 mA.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2024 · Layered coordination polymer with two-dimensional covalent bismuth-organic networks: Semiconductor and lithium ion storage

single crystal of Bi-DSBDC-DMA · Single Crystal · Selected crystal on Bruker Smart 6000 CCD diffractometer; 100.0 K; structure solved with Olex2/ShelXT and refined with XL least-squares.

Diffraction StructurePowderRefinement

PXRD Pawley refinement

2024 · Macrocyclic ligand-driven ion selectivity and high surface area in a 2D conductive MOF

pristine Cu-EP powder · Powder · Cu K-alpha source, wavelength 1.540510 A; simulated packing model comparison

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Manipulating Photoconduction in Cu-Pyrene 1-D Coordination Nanosheets by Modulating Interlayer π-π Stacking

Cu-PTT nanosheet powder · Nanosheet · PXRD using Cu Kalpha radiation source per SI standard characterisation.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Manipulating Photoconduction in Cu-Pyrene 1-D Coordination Nanosheets by Modulating Interlayer π-π Stacking

Cu-tBuPTT nanosheet powder · Nanosheet · PXRD using Cu Kalpha radiation source per SI standard characterisation.

Diffraction StructurePowder

PXRD with Cu K-alpha radiation

2024 · Metal-organic frameworks with fine-tuned interlayer spacing for microwave absorption

Zn3Cu1-HHTP powder/rod crystals · Powder · XRD DMAX-2500PC; 2 theta range 3 to 60 degrees.

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2024 · Mixed metal conductive MOFs constructed from Trypan blue linked metal nodes: characteristic features and electrochemical performance

Cu-Try MOF powder (E) · Powder · Powder XRD patterns and structural assignment

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2024 · Mixed metal conductive MOFs constructed from Trypan blue linked metal nodes: characteristic features and electrochemical performance

Cu-Co-Try MOF powder (P1) · Powder · Powder XRD patterns and structural assignment

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2024 · Mixed metal conductive MOFs constructed from Trypan blue linked metal nodes: characteristic features and electrochemical performance

Cu-Zn-Try MOF powder (P2) · Powder · Powder XRD patterns and structural assignment

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2024 · Mixed metal conductive MOFs constructed from Trypan blue linked metal nodes: characteristic features and electrochemical performance

Cu-Er-Try MOF powder (P3) · Powder · Powder XRD patterns and structural assignment

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2024 · Mixed metal conductive MOFs constructed from Trypan blue linked metal nodes: characteristic features and electrochemical performance

Cu-Yb-Try MOF powder (P4) · Powder · Powder XRD patterns and structural assignment

Diffraction StructureUnspecified subtype

XRD and UV-vis absorption

2024 · MOF-enabled high-density 2D molecular crystal optoelectronic memory transistor with floating gate architecture

Pristine DTT-8 two-dimensional molecular crystal film · Single Crystal · Crystal orientation and optical absorption of DTT-8 2DMC.

Diffraction StructurePowder

PXRD with Le Bail fitting

2024 · Molecular-Level Pore Tuning in 2D Conductive Metal-Organic Frameworks for Advanced Supercapacitor Performance

Cu3(HHTATP)2 dark powder · Powder · Rigaku MiniFlex, Cu Kalpha, 3-50 deg 2theta, 0.02 deg interval, 1 deg min-1; FullProf Le Bail fit to near-eclipsed AA structure.

Diffraction StructureGrazing incidence

Grazing-incidence X-ray diffraction (GIXRD)

2024 · Morphology Control of Mixed Metallic Organic Framework for High-Performance Hybrid Supercapacitors

Benzoic Acid-80 · Electrode · Benzoic acid-80 and benzoic series compared; NiCoO2, Ni substrate and NiCo-MOF peaks assigned.

Diffraction StructureGrazing incidence

Grazing-incidence X-ray diffraction (GIXRD)

2024 · Morphology Control of Mixed Metallic Organic Framework for High-Performance Hybrid Supercapacitors

H2BDC-80 · Electrode · H2BDC-60/80/100 series; NiCoO2 and NiCo-MOF diffraction assignments.

Diffraction StructureGrazing incidence

Grazing-incidence X-ray diffraction (GIXRD)

2024 · Morphology Control of Mixed Metallic Organic Framework for High-Performance Hybrid Supercapacitors

H3BTC-100 · Electrode · H3BTC-60/80/100 series; NiCoO2, Ni and NiCo-MOF diffraction assignments.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2024 · Morphology-driven electrochemical attributes of Cu-MOF: a high-performance anodic material for battery supercapacitor hybrids

Q1 hydrothermal Cu-MOF powder · Powder · Experimental XRD compared with simulated XRD pattern, CCDC no. 226294.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2024 · Morphology-driven electrochemical attributes of Cu-MOF: a high-performance anodic material for battery supercapacitor hybrids

Q2 sonochemical Cu-MOF powder · Powder · Experimental XRD compared with simulated XRD pattern, CCDC no. 226294.

Diffraction StructureUnspecified subtype

X-ray diffraction (Cu Kalpha, Rigaku Rint-2000)

2024 · NiCo-MOFs in situ anchored on graphdiyne with metal-like properties form a strongly coupled electron transport interface and construct an ohmic contact to achieve efficient charge-hole spatial separation

Cu-GDY (CG) · Powder · phase assignment of CG

Diffraction StructureUnspecified subtype

X-ray diffraction (Cu Kalpha, Rigaku Rint-2000)

2024 · NiCo-MOFs in situ anchored on graphdiyne with metal-like properties form a strongly coupled electron transport interface and construct an ohmic contact to achieve efficient charge-hole spatial separation

pure NiCo-MOF (NC) · Powder · phase assignment of pristine NC

Diffraction StructureUnspecified subtype

X-ray diffraction

2024 · NiCo-MOFs in situ anchored on graphdiyne with metal-like properties form a strongly coupled electron transport interface and construct an ohmic contact to achieve efficient charge-hole spatial separation

NCCG-15 · Powder · composite phase assignment for NCCG-X series

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2024 · Novel 2D CuFe-MOF-based immunoprobe: Addressing antifouling electrochemical immunosensing inadequate sensitivity challenge

Cu2O nanocubes · Powder · Compared against Cu2O standard card COD-1000063.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2024 · Novel 2D CuFe-MOF-based immunoprobe: Addressing antifouling electrochemical immunosensing inadequate sensitivity challenge

Cu-BDC nanosheets · Nanosheet · Cu-BDC nanosheets and Cu-BDC bulk compared with COD-687690.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2024 · Novel 2D CuFe-MOF-based immunoprobe: Addressing antifouling electrochemical immunosensing inadequate sensitivity challenge

2D CuFe-MOF · Nanosheet · CuFe-MOF compared with Cu-BDC bulk and FeO2 reference peaks.

Diffraction StructurePowder

powder X-ray diffraction (XRD)

2024 · Novel electrochemical sensing strategy for ultrasensitive detection of tetracycline based on porphyrin/metal phthalocyanine-covalent organic framework

CuTAPc-TFPP-COF powder · Powder · Rigaku D/Max-2500 X-ray diffractometer using Cu Kalpha radiation.

Diffraction StructurePowder

powder X-ray diffraction (XRD)

2024 · Ordered layered manganese-based metal–organic frameworks induce 2D growth of discharge products via LiO2 adsorbent for high performance lithium–oxygen batteries

Mn-MOF temperature-series powders · Powder · Cu-Kalpha radiation, 2theta range 10-80 degrees, Rigaku D/MAX 2500/PC diffractometer

Diffraction StructurePowder

powder X-ray diffraction

2024 · Organic Solvent Boosts Charge Storage and Charging Dynamics of Conductive MOF Supercapacitors

near-ideal Ni3(HITP)2 crystallite powder · Powder · PANalytical Empyrean Cu sealed tube, lambda = 1.544426 Angstrom, 40 kV, 40 mA; thin powder layer on roughened glass plate.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2024 · Photocatalytic Hydrogen Peroxide Production through Functionalized Semiconductive Metal-Organic Frameworks

DPT-MOF powder · Powder · Cu source, wavelength 1.5418 Angstrom; compared to simulated structure.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2024 · Photocatalytic Hydrogen Peroxide Production through Functionalized Semiconductive Metal-Organic Frameworks

EFB-MOF powder · Powder · Cu source, wavelength 1.5418 Angstrom; compared to simulated structure.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2024 · Photocatalytic Hydrogen Peroxide Production through Functionalized Semiconductive Metal-Organic Frameworks

PA-MOF powder · Powder · Cu source, wavelength 1.5418 Angstrom; compared to simulated structure.

Electrochemistry ApplicationPowder

Photocatalytic cycling stability with PXRD/FTIR checks

2024 · Photocatalytic Hydrogen Peroxide Production through Functionalized Semiconductive Metal-Organic Frameworks

EFB-MOF powder · Powder · EFB-MOF H2O2 production over five cycles; each data point at a 15 min interval; PXRD and FTIR before and after irradiation.

Diffraction StructureUnspecified subtype

X-ray diffraction (PANalytical instrument)

2024 · Plasma-catalytic removal of toluene over bimetallic M/Mn-BTC catalysts in dielectric barrier discharge reactor

Co/Mn-BTC / Co/Mn-BTC-1 · Powder · Powder XRD patterns of prepared catalysts

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2024 · Reaction-Type-Dependent Behavior of Redox-Hopping in MOFs─Does Charge Transport Have a Preferred Direction?

Ru-NU-1000 particles · Powder · NU-1000 and Ru-NU-1000 PXRD patterns compared with simulated NU-1000; SI instrument Rigaku Miniflex, Cu Kalpha lambda = 1.5418 A, 2 mA, 40 kV.

Diffraction StructureRefinement

Rietveld refinement of XRD

2024 · Regulating Electronic Structure of Bimetallic NiFe-THQ Conductive Metal–Organic Frameworks to Boost Catalytic Activity for Oxygen Evolution Reaction

Fe-THQ · Powder · Fe-THQ used as structural analysis example; cubic Pm-3 model.

Diffraction StructurePowder

powder X-ray diffraction

2024 · Regulating Electronic Structure of Bimetallic NiFe-THQ Conductive Metal–Organic Frameworks to Boost Catalytic Activity for Oxygen Evolution Reaction

NixFe1-x-THQ series · Powder · Cu Kalpha radiation; series XRD patterns compared with simulated/refined patterns.

Diffraction StructurePowderRefinement

Powder XRD and Le Bail refinement

2024 · Revealing the effect of cobalt content and ligand exchange in the bimetallic Ni–Co MOF for stable supercapacitors with high energy density

KNiCoPO4 powder · Powder · Compared with orthorhombic KNiPO4.H2O reference; Pmn21 space group

Diffraction StructurePowder

Powder X-ray diffraction with Cu Kalpha radiation

2024 · Reversible Molecule Interactions Enable Ultrastretchable and Recyclable Ionogels for Wearable Piezoionic Sensors

as-synthesised UiO-66-NH2 light-yellow powder · Powder · Room-temperature ambient XRD using X'Pert-Pro MPD at 50 kV and 50 mA.

Diffraction StructureUnspecified subtype

Ex-situ XRD before and after NO2 exposure

2024 · Single-Atom Catalysts in Conductive Metal-Organic Frameworks: Enabling Reversible Gas Sensing at Room Temperature

Pd1-cMOF powder · Powder · Pristine cMOF and Pd1-cMOF compared before and after NO2 exposure.

Diffraction StructurePowder

PXRD before and after CO2 capture/release cycling

2024 · Solid-State Electrochemical Carbon Dioxide Capture by Conductive Metal-Organic Framework Incorporating Nickel Bis(diimine) Units

Ni3(HITP)2 recovered after capture-release cycling · Powder · Recovered MOF stripped from CFP, washed with DMSO/ethanol/acetone, dried at 40 C and remeasured.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Kalpha source

2024 · Solid-State Electrochemical Carbon Dioxide Capture by Conductive Metal-Organic Framework Incorporating Nickel Bis(diimine) Units

Ni(DIB)2 crystals/powder · Powder · Experimental and simulated PXRD pattern for Ni(DIB)2; Rigaku MiniFlex instrument described in SI.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Kalpha source

2024 · Solid-State Electrochemical Carbon Dioxide Capture by Conductive Metal-Organic Framework Incorporating Nickel Bis(diimine) Units

As-synthesised Ni3(HITP)2 dark-blue powder · Powder · Rigaku sixth-generation MiniFlex; 600 W, 40 kV, 15 mA; CuKalpha alpha = 1.54 A.

Diffraction StructurePowder

PXRD

2024 · Successful In Situ Growth of Conductive MOFs on 2D Cobalt-Based Compounds and Their Electrochemical Performance

Ni-HHTP@Co(OH)2 · Electrode · Cu K-alpha PXRD; comparison to Ni-HHTP and Co(OH)2 reference peaks

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2024 · Superior Charge Transport in Ni-Diamine Conductive MOFs

Pristine Cu3(HITT)2 black powder · Powder · Laboratory PXRD; hexagonal model refinement.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2024 · Superior Charge Transport in Ni-Diamine Conductive MOFs

Pristine Ni3(HITT)2 black powder · Powder · Laboratory PXRD; hexagonal model refinement.

Diffraction StructurePowder

in-situ VT-PXRD

2024 · Superior Charge Transport in Ni-Diamine Conductive MOFs

Pristine Cu3(HITT)2 black powder · Powder · PANalytical X'Pert Pro with Cu target; samples on alumina plate under helium flow.

Diffraction StructurePowder

in-situ VT-PXRD

2024 · Superior Charge Transport in Ni-Diamine Conductive MOFs

Pristine Ni3(HITT)2 black powder · Powder · PANalytical X'Pert Pro with Cu target; samples on alumina plate under helium flow.

Diffraction StructurePowder

powder XRD

2024 · Synergistic Enhancement of Supercapacitors with Cobalt–Copper Bimetal–Organic Framework

CoCu-MOF powder, Co:Cu = 6:1 feed · Powder · Bruker diffractometer with Cu radiation, 40 kV, 120 mA

Diffraction StructurePowderRefinement

Synchrotron PXRD with Pawley/Rietveld refinement and laboratory PXRD

2024 · Synthesis and structure of a non-van-der-Waals two-dimensional coordination polymer with superconductivity

Cu3BHT micro-crystal array / multicrystalline film · Thin Film · Synchrotron radiation lambda = 0.458086 Angstrom; lab PXRD Cu Kalpha lambda = 1.5406 Angstrom, 2theta 5-60 degrees, 0.023 degree step, 60 s exposure.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Rietveld phase quantification

2024 · Synthesis and structure of anhydrous Zn2EDTA metal-organic framework

pH-dependent Zn-EDTA hydrothermal powder series · Powder · Samples synthesised at pH 2.5-3.4 with Zn:EDTA 2:1; MiniFlex Benchtop Rigaku XRD with Cu source, lambda Kalpha1 = 1.54056 A and Kalpha2 = 1.54439 A; Rietveld with TOPAS.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; Bruker D8 QUEST; Mo-target X-ray tube; Olex2/ShelXT/ShelXL refinement

2024 · Synthesis and structure of anhydrous Zn2EDTA metal-organic framework

single crystal of Zn2EDTA picked from powder sample · Single Crystal · PHOTONII detector, Mo radiation; main text gives lambda = 0.73071 A but Table 1/CIF give MoKalpha lambda = 0.71073 A; crystal kept at 110.15 K; numerical absorption correction used for final solution.

Diffraction StructurePowder

PXRD

2024 · Synthesis of a highly conductive coordination polymer film via a vapor-solid phase chemical conversion process

Ag2O film without H6BHT · Thin Film · PXRD after exposing Ag2O film without evaporated H6BHT to isopropanol post-reaction conditions.

Diffraction StructurePowder

powder X-ray diffraction, Cu Ka radiation

2024 · Synthesis of a highly conductive coordination polymer film via a vapor-solid phase chemical conversion process

Scraped Ag5BHT thin-film powder · Powder · PXRD on Ag5BHT obtained by repeatedly scraping off the thin film; 2-60 deg scan range at 0.026 deg s^-1 per SI.

Diffraction StructurePowder

powder X-ray diffraction

2024 · Synthesis of a highly conductive coordination polymer film via a vapor-solid phase chemical conversion process

Crystalline Ag5BHT powder from vapour-solid conversion · Powder · PXRD comparison of solvent-phase Ag5BHT powder, vapour-solid Ag5BHT powder, H6BHT ligand, and Ag2O.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SC-XRD), XtaLAB Synergy-S

2024 · Synthesis of millimeter-scale ZIF-8 single crystals and their reversible crystal structure changes

as-synthesised SC-ZIF-8 single crystals · Single Crystal · Approximately 0.1 mm crystal; Cu K alpha radiation; temperature increased from 100 to 500 K in 100 K intervals at 100 K h-1; 30 min equilibration at each target temperature.

Diffraction StructurePowderRefinement

powder X-ray diffraction (PXRD) with Rietveld refinement

2024 · Synthesis of Stable 2D Conductive Lanthanide Organic Frameworks (Lu-HHTP) for High-Performance Humidity Sensors

Lu-HHTP black powder · Powder · PXRD used to refine average disordered Lu-HHTP structure; SI instrument Cu Kalpha radiation lambda = 1.5418 Angstrom at 298 K, scan range 2-40 deg

Diffraction StructurePowder

PXRD before and after water soaking

2024 · Synthesis of Stable 2D Conductive Lanthanide Organic Frameworks (Lu-HHTP) for High-Performance Humidity Sensors

Lu-HHTP after water or humidity exposure · Powder · PXRD patterns compared before and after soaking Lu-HHTP in water for 24 h

Diffraction StructurePowder

Powder X-ray diffraction

2024 · Synthesis, Characterization, and Catalytic Performance of a New Heterobimetallic Y/Tb Metal-Organic Framework with High Catalytic Activity

Tb-MOF bulk catalyst powder/crystals · Powder · Cu Kalpha radiation, 5 < 2theta < 50 deg, step 0.02 deg, 2.5 s per step at 25 C.

Diffraction StructurePowder

Powder X-ray diffraction

2024 · Synthesis, Characterization, and Catalytic Performance of a New Heterobimetallic Y/Tb Metal-Organic Framework with High Catalytic Activity

Y/Tb-MOF bulk catalyst powder/crystals · Powder · Cu Kalpha radiation, 5 < 2theta < 50 deg, step 0.02 deg, 2.5 s per step at 25 C.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction/refinement

2024 · Synthesis, Characterization, and Catalytic Performance of a New Heterobimetallic Y/Tb Metal-Organic Framework with High Catalytic Activity

Y/Tb-MOF hexagonal single crystals · Single Crystal · 296 K; Mo Kalpha radiation; SHELXT/SHELXL/OLEX2 refinement; PLATON squeeze for residual pore electron density.

Microscopy MorphologyUnspecified subtype

XRD plus top-view and cross-section SEM

2024 · Three-type precursors for low-temperature solution-processed void-and-crack-free copper(I) iodide films: comparison of electrical conductivities and optical transparency

CuI(1A2P) film on FTO · Thin Film · CuI(1A2P) films on FTO glass substrate using 0.13, 0.26, 0.35 and 0.50 M precursor solutions.

Diffraction StructurePowder

Powder X-ray diffraction using Rigaku MiniFlex II with Cu K alpha 1 radiation

2024 · Three-type precursors for low-temperature solution-processed void-and-crack-free copper(I) iodide films: comparison of electrical conductivities and optical transparency

CuI(1A2P) film on glass · Thin Film · CuI films from AN/DES (0.13 M) and 2AE/1A2P (0.26 M) after heating at various temperatures; gamma-CuI reference no. 01-070-2453.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha radiation

2024 · Toward Enhancing Performance of Electromagnetic Wave Absorption for Conductive Metal-Organic Frameworks: Nanostructure Engineering or Crystal Morphology Controlling

A-Cu-HHTP nanosheet powder · Nanosheet · 3-50 degrees 2theta, 40 kV, 40 mA; compared with simulated phase-1 stacking patterns.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha radiation

2024 · Toward Enhancing Performance of Electromagnetic Wave Absorption for Conductive Metal-Organic Frameworks: Nanostructure Engineering or Crystal Morphology Controlling

B-Cu-HHTP nanorod powder · Powder · 3-50 degrees 2theta, 40 kV, 40 mA; compared with simulated phase-1 and near phase-1 patterns.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha radiation

2024 · Toward Enhancing Performance of Electromagnetic Wave Absorption for Conductive Metal-Organic Frameworks: Nanostructure Engineering or Crystal Morphology Controlling

C-Cu-HHTP nanoball powder · Powder · 3-50 degrees 2theta, 40 kV, 40 mA; compared with simulated phase-1 stacking patterns.

Diffraction StructurePowder

powder X-ray diffraction

2024 · Tri-Metallic Catalyst for Oxygen Evolution Reaction Enables Continuous Operation of Anion Exchange Membrane Electrolyzer at 1A cm−2 for Hundreds of Hours

All synthesised MOF-74 analogues · Powder · Simulated crystalline MOF-74 pattern compared with all synthesised analogues; SI Figures S1-S4 supplied and checked.

Diffraction StructurePowder

PXRD with Le Bail fitting; Cu Kalpha radiation

2024 · Triazacoronene-Based 2D Conductive Metal–Organic Framework for High-Capacity Lithium Storage

as-synthesised Cu-TAC powder · Powder · Experimental PXRD compared with simulated AA and AB stacking structures.

SpectroscopyPowder

EDS, XPS, EPR, TGA and post-soaking PXRD stability checks

2024 · Triazacoronene-Based 2D Conductive Metal–Organic Framework for High-Capacity Lithium Storage

as-synthesised Cu-TAC powder · Powder · Elemental composition, Cu valence, paramagnetic signal, thermal decomposition and crystallinity after water/electrolyte immersion.

Diffraction StructureUnspecified subtype

XRD and FTIR comparison

2024 · Triggering Anodic Luminol Electrochemiluminescence through Electrostatic Interactions: An Innovative Approach Utilizing Conductive Metal-Organic Framework Co-HHTP

luminol@Co-HHTP powder · Powder · Luminol@Co-HHTP, Co-HHTP, Luminol@Ni-HHTP and Ni-HHTP compared by XRD/FTIR.

Diffraction StructurePowder

powder X-ray diffraction

2024 · Triggering Anodic Luminol Electrochemiluminescence through Electrostatic Interactions: An Innovative Approach Utilizing Conductive Metal-Organic Framework Co-HHTP

Co-HHTP powder · Powder · Rigaku Ultima IV powder X-ray diffractometer; conditions otherwise not reported.

Diffraction StructurePowder

powder X-ray diffraction

2024 · Triggering Anodic Luminol Electrochemiluminescence through Electrostatic Interactions: An Innovative Approach Utilizing Conductive Metal-Organic Framework Co-HHTP

Ni-HHTP powder · Powder · Ni-HHTP powder; SI Figure S1A.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2024 · Two-Dimensional Conjugated Metal–Organic Frameworks with a Ring-in-Ring Topology and High Electrical Conductance

Co-DHHBTN powder · Powder · Rigaku Cu Kalpha and synchrotron PXRD; simulated patterns by Materials Studio Reflex Plus.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2024 · Two-Dimensional Conjugated Metal–Organic Frameworks with a Ring-in-Ring Topology and High Electrical Conductance

Cu-DHHBTN powder · Powder · Rigaku Cu Kalpha and synchrotron PXRD; simulated patterns by Materials Studio Reflex Plus.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2024 · Two-Dimensional Conjugated Metal–Organic Frameworks with a Ring-in-Ring Topology and High Electrical Conductance

Ni-DHHBTN powder · Powder · Rigaku Cu Kalpha and synchrotron PXRD; simulated patterns by Materials Studio Reflex Plus.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2024 · Unleashing the room temperature boronization: Blooming of Ni-ZIF nanobuds for efficient photo/electro catalysis of water

24-BNZ powder / 24 h boronized Ni-ZIF · Powder · Comparison of bare NZ and 24-BNZ; broader (211) and loss of peaks after 24 h boronization.

Diffraction StructureUnspecified subtype

XRD before and after photocatalytic study

2024 · Unleashing the room temperature boronization: Blooming of Ni-ZIF nanobuds for efficient photo/electro catalysis of water

24-BNZ powder / 24 h boronized Ni-ZIF · Powder · Fresh and used 24-BNZ after photocatalytic study compared by XRD.

Diffraction StructurePowder

Powder X-ray diffraction

2024 · Upgrading Structural Conjugation in Three-Dimensional Ni-Based Metal-Organic Frameworks for Promoting Electrical Conductivity and Specific Capacitance

as-synthesised Ni-BPE crystals · Single Crystal · PANalytical EMPYREAN; Cu Kalpha; 2theta 5-50 degrees

Diffraction StructurePowder

Powder X-ray diffraction

2024 · Upgrading Structural Conjugation in Three-Dimensional Ni-Based Metal-Organic Frameworks for Promoting Electrical Conductivity and Specific Capacitance

as-synthesised Ni-BPY crystals · Single Crystal · PANalytical EMPYREAN; Cu Kalpha; 2theta 5-50 degrees

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2024 · Upgrading Structural Conjugation in Three-Dimensional Ni-Based Metal-Organic Frameworks for Promoting Electrical Conductivity and Specific Capacitance

as-synthesised Ni-BPE crystals · Single Crystal · Bruker APEX-II CCD; graphite-monochromic Mo Kalpha radiation, lambda = 0.71073 A; data collected at 273.15 K; structure refined with SHELXTL-97/OLEX-2

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2024 · ZnS/MnO2 metal organic framework based conductive hydrogel for highly selective and sensitive detection of glutathione in serum samples

2 wt% ZnS/MnO2-MOF hydrogel electrode · Electrode · Cu-Kalpha source, wavelength 1.54 A; 2theta range 20-70 deg.

Diffraction StructurePowderRefinement

PXRD, Pawley fitting and structural fitting

2023 · 2D conjugated metal-organic framework as a proton-electron dual conductor

Zn-HHTP-urea powder · Powder · PXRD of urea-treated MOF; Cu K alpha radiation lambda = 1.5418 Angstrom for SI refinement and Figure 4B.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2023 · A chiral SrSi2 (srs) superstructure constructed by a dual interaction system showing isotropic electrical conductivity

Crystals of compound 1 · Single Crystal · PXRD obtained on Rigaku 2100 with CuKalpha radiation and flat plate geometry; patterns for compound 1 and regenerated 1 are cited.

Diffraction StructurePowder

XRD/PXRD pattern of drop-cast thin film

2023 · A chiral SrSi2 (srs) superstructure constructed by a dual interaction system showing isotropic electrical conductivity

Drop-cast thin film of compound 1 · Thin Film · SI caption reports XRD pattern of a thin film fabricated by drop casting.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction and crystallographic refinement

2023 · A chiral SrSi2 (srs) superstructure constructed by a dual interaction system showing isotropic electrical conductivity

Crystals of compound 1 · Single Crystal · Bruker D8 Venture/Bruker APEX-II CCD with Mo-Kalpha radiation; data harvested at 200 K; structure solved/refined with SHELXTL/SHELXL; CIF reports cubic P 41 3 2.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD) and profile fitting

2023 · A Conductive 2D Conjugated Tetrathia[8]circulene-Based Nickel Metal–Organic Framework for Energy Storage

as-synthesised Ni-TTC black powder · Powder · Rigaku MiniFlex 600, Cu sealed tube lambda = 1.54178 A at 40 kV and 15 mA; comparison with DFT simulated stacking models

Diffraction StructurePowder

PXRD and FT-IR

2023 · A Conductive Metal−Organic Framework Based on Triptycene Ligand: An Effective Electrochemical Sensor for Glucose and H2O2 Detection in Food and Human Serum

Cu-HHTT MOF domains in Cu-HHTT/CF · Unknown · PXRD at room temperature using Rigaku D/MAX 2550 with lambda = 1.5418 A; FT-IR by Nicolet iS 50.

Diffraction StructurePowder

PXRD

2023 · A Humidity-Induced Large Electronic Conductivity Change of 107 on a Metal-Organic Framework for Highly Sensitive Water Detection

H2SO4@(NH2)2-MIL-125 powder · Powder · PXRD patterns compared before and after H2SO4 treatment and after 100 percent RH exposure

Diffraction StructurePowder

FTIR and powder XRD

2023 · A Novel Electrocatalyst Pd(II)@Ni3(HITP)2 for Ultrasensitive Detection of Chloramphenicol: Experimental and Computational Investigation

Pd(II)@Ni3(HITP)2, PdCl2 loading mass 0.05 mL/mg · Powder · FTIR spectra and XRD graph comparing Ni3(HITP)2 and Pd(II)@Ni3(HITP)2.

Diffraction StructurePowder

PXRD after solvent soaking

2023 · A Pyrazine-Based 2D Conductive Metal-Organic Framework for Efficient Lithium Storage†

As-synthesised TPQG-Cu-MOF black powder · Powder · TPQG-Cu-MOF soaked in ten solvents at room temperature for four days.

Diffraction StructurePowder

PXRD with Williamson-Hall analysis; SEM morphology

2023 · A simplistic approach for the synthesis of Covalent Organic Frameworks(COFs) comprising of tetrafunctionalized porphyrin and polyoxometalates to uncover catalytic applications

P@Cu-AndCOF bulk solid · Powder · Bulk P@Cu-AndCOF powder/solid.

Diffraction StructurePowder

PXRD with Williamson-Hall analysis; SEM morphology

2023 · A simplistic approach for the synthesis of Covalent Organic Frameworks(COFs) comprising of tetrafunctionalized porphyrin and polyoxometalates to uncover catalytic applications

P@Ni-AndCOF bulk solid · Powder · Bulk P@Ni-AndCOF powder/solid.

Diffraction StructurePowder

PXRD/FT-IR chemical stability tests

2023 · A tribenzocoronene-based 2D conductive metal-organic framework for efficient energy storage

as-prepared Cu-TBC black powder · Powder · Immersion in acidic, alkaline and organic solvents for 72 h; PXRD and FT-IR compared before/after

Diffraction StructurePowder

Post-CO2RR PXRD, FT-IR, HR-TEM, EDS, XPS, Cu LMM Auger

2023 · A Triptycene-Based 2D MOF with Vertically Extended Structure for Improving the Electrocatalytic Performance of CO2 to Methane

2D-vc-MOF(Cu) glassy carbon working electrode · Electrode · Catalyst characterised after CO2RR electrolysis for structural and compositional retention.

Diffraction StructurePowderRefinement

PXRD, HR-TEM/SAED, Pawley refinement

2023 · A Triptycene-Based 2D MOF with Vertically Extended Structure for Improving the Electrocatalytic Performance of CO2 to Methane

2D-vc-MOF(Cu) blue-black powder · Powder · Experimental PXRD compared with AA, AB, and AA' stacking models; HR-TEM and SAED used for lattice/interlayer spacing.

Diffraction StructurePowder

PXRD after solvent immersion

2023 · A Triptycene-Based 2D MOF with Vertically Extended Structure for Improving the Electrocatalytic Performance of CO2 to Methane

2D-vc-MOF(Cu) blue-black powder · Powder · Immersed in dichloromethane, acetone, methanol, H2O, and THF for two days, then PXRD compared.

Diffraction StructureUnspecified subtype

Out-of-plane XRD with Cu Kalpha radiation

2023 · Ag Nanoparticles-Induced Metallic Conductivity in Thin Films of 2D Metal-Organic Framework Cu3(HHTP)2

AgNPs@Cu3(HHTP)2 thin film · Thin Film · Room-temperature XRD pattern after AgNP incorporation

Diffraction StructureUnspecified subtype

Out-of-plane XRD with Cu Kalpha radiation

2023 · Ag Nanoparticles-Induced Metallic Conductivity in Thin Films of 2D Metal-Organic Framework Cu3(HHTP)2

AgNPs@CuTCNQ thin film · Thin Film · Room-temperature XRD pattern after AgNP modification

Diffraction StructureUnspecified subtype

Out-of-plane XRD with Cu Kalpha radiation

2023 · Ag Nanoparticles-Induced Metallic Conductivity in Thin Films of 2D Metal-Organic Framework Cu3(HHTP)2

Pristine Cu3(HHTP)2 thin film · Thin Film · Room-temperature XRD pattern compared to simulated Cu3(HHTP)2

Diffraction StructureUnspecified subtype

Out-of-plane XRD with Cu Kalpha radiation

2023 · Ag Nanoparticles-Induced Metallic Conductivity in Thin Films of 2D Metal-Organic Framework Cu3(HHTP)2

Pristine CuTCNQ thin film · Thin Film · Room-temperature XRD pattern compared to simulated CuTCNQ

Diffraction StructureGrazing incidence

Out-of-plane XRD and grazing-incidence in-plane XRD

2023 · Air/liquid interfacial formation process of conductive metal–organic framework nanosheets

HITP-Ni-NS_1 min · Nanosheet · HITP-Ni-NS deposited on Si substrates; synchrotron X-ray source lambda = 1.24 Angstrom, helium flow; additional SmartLab Cu K-alpha measurements.

Diffraction StructurePowder

Powder XRD

2023 · Anionic metal-organic framework modified separator boosting efficient Li-ion transport

UIOSOL@PP separator · Thin Film · XRD spectrum of UIOSOL@PP separator.

Diffraction StructurePowder

Powder XRD

2023 · Anionic metal-organic framework modified separator boosting efficient Li-ion transport

UIO-SOLi nanoparticles · Powder · Cu Kalpha radiation; UIO-66, UIO-SOH and UIO-SOLi patterns compared.

Diffraction StructurePowder

PXRD

2023 · Boosting electrocatalytic CO2 reduction reaction over viologen-functionalized metal-organic frameworks by enhancement of electron-transfer capacity

MOF sample series · Powder · Synchrotron PXRD compared Vg-MOF, Por(Co)-MOF and Vg-Por(Co)-MOF(n:1) with simulated Zn-DPDBP-UiO.

OtherPowder

TGA and post-CO2RR PXRD

2023 · Boosting electrocatalytic CO2 reduction reaction over viologen-functionalized metal-organic frameworks by enhancement of electron-transfer capacity

MOF sample series · Powder · Thermostability and KHCO3/post-electrocatalysis structural stability checks.

Diffraction StructureGrazing incidence

Synchrotron 2D-GIXRD reciprocal-space mapping

2023 · Chemical Vapor Deposition and High-Resolution Patterning of a Highly Conductive Two-Dimensional Coordination Polymer Film

20 nm CVD Cu-BHT nanofilm · Thin Film · Elettra XRD1 beamline; wavelength 1.4 A, incident angle ca. 0.5 deg.

Diffraction StructureGrazing incidence

Synchrotron micro-XRD line scan in grazing-incidence mode

2023 · Chemical Vapor Deposition and High-Resolution Patterning of a Highly Conductive Two-Dimensional Coordination Polymer Film

Bottom-up lift-off patterned CVD Cu-BHT features · Thin Film · DESY P23 beamline; beam focused to 1 x 3.5 um2; incident angle ca. 0.15 deg.

Diffraction StructurePowder

PXRD and SEM

2023 · Chemical Vapor Deposition and High-Resolution Patterning of a Highly Conductive Two-Dimensional Coordination Polymer Film

Solvent-free Cu-BHT powder product · Powder · PXRD in transmission mode over 1.2 deg < 2theta < 45 deg; SEM at 10 keV after 2 nm Pt coating.

Diffraction StructurePowder

In situ powder X-ray diffraction under CO2

2023 · CO2-Sensitive Porous Magnet: Antiferromagnet Creation from a Paramagnetic Charge-Transfer Layered Metal-Organic Framework

Activated crystals of compound 1 · Single Crystal · Ground sample sealed in silica capillary connected to BELSORP MAX; Cu Kalpha radiation; CO2 pressures 3.2, 10, 32, and 100 kPa; temperature varied under N2 stream.

Diffraction StructureSingle crystal

In situ single-crystal X-ray diffraction

2023 · CO2-Sensitive Porous Magnet: Antiferromagnet Creation from a Paramagnetic Charge-Transfer Layered Metal-Organic Framework

CO2-dosed single crystal of 1 for SCXRD · Single Crystal · 100 kPa CO2 introduced at room temperature and slowly cooled to 195 K; Mo Kalpha radiation; structure solved/refined with SHELXT/F2 refinement.

Diffraction StructurePowder

PXRD after MnO4- adsorption/exchange

2023 · Conductive Lanthanide Metal-Organic Frameworks with Exceptionally High Stability

Gd4-MOF after MnO4- anion exchange · Single Crystal · as-synthesised versus after adsorption with MnO4-

Diffraction StructurePowder

powder X-ray diffraction

2023 · Conductive Lanthanide Metal-Organic Frameworks with Exceptionally High Stability

as-synthesised Gd4-MOF single crystals · Single Crystal · as-synthesised Gd4-MOF compared with simulated PXRD

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2023 · Conductive Lanthanide Metal-Organic Frameworks with Exceptionally High Stability

as-synthesised Gd4-MOF single crystals · Single Crystal · Cu Kalpha radiation, 100 or 256 K; SHELXTL-97 refinement

Diffraction StructurePowder

PXRD after pH/boiling-water treatment

2023 · Conductive Lanthanide Metal-Organic Frameworks with Exceptionally High Stability

as-synthesised Gd4-MOF single crystals · Single Crystal · Gd4-MOF immersed in pH 1 HCl, pH 12 NaOH, water 100 C, and stored 2 years; Tm/Lu pH 1 and 12 in SI

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2023 · Conductive Lanthanide Metal-Organic Frameworks with Exceptionally High Stability

as-synthesised Lu4-MOF single crystals · Single Crystal · Cu Kalpha radiation, 100 or 256 K; SHELXTL-97 refinement

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2023 · Conductive Lanthanide Metal-Organic Frameworks with Exceptionally High Stability

as-synthesised Tm4-MOF single crystals · Single Crystal · Cu Kalpha radiation, 100 or 256 K; SHELXTL-97 refinement

Diffraction StructurePowder

powder X-ray diffraction

2023 · Conductive metal-organic framework flowers facilitate the anchoring and conversion kinetics of polysulfides for lithium‑sulfur batteries

MIL-47 powder / nanosheets collected from autoclave · Powder · Rigaku SmartLab XRD; MIL-47/CNT compared with MIL-47 powder.

Diffraction StructurePowder

powder X-ray diffraction (Bruker D8 ADVANCE, Cu Kalpha)

2023 · Conductive metal-organic frameworks with wheel-shaped metallomacrocycle subunits as high-performance supercapacitor electrodes

MWM-1 (Co/2Ni) powder/crystals · Powder · 40 kV, 40 mA, step size 0.01 deg, scan speed 0.1 s step-1; comparison with simulated SXRD patterns

Diffraction StructurePowderRefinement

PXRD with Pawley refinement and simulated PXRD comparison

2023 · Conjugated Nonplanar Copper-Catecholate Conductive Metal-Organic Frameworks via Contorted Hexabenzocoronene Ligands for Electrical Conduction

c-HBC-12O-Cu black powder · Powder · PXRD collected on RIGAKU SMARTLAB 9KW with Cu target and graphite monochromator; structure optimised and refined against PXRD.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement and simulated PXRD comparison

2023 · Conjugated Nonplanar Copper-Catecholate Conductive Metal-Organic Frameworks via Contorted Hexabenzocoronene Ligands for Electrical Conduction

c-HBC-6O-Cu black powder · Powder · PXRD collected at BSRF beamline 1W1A; structure optimised using universal force field and refined against PXRD.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement and simulated PXRD comparison

2023 · Conjugated Nonplanar Copper-Catecholate Conductive Metal-Organic Frameworks via Contorted Hexabenzocoronene Ligands for Electrical Conduction

c-HBC-8O-Cu black powder · Powder · PXRD collected at BSRF beamline 1W1A; structure optimised using universal force field and refined against PXRD.

Diffraction StructureUnspecified subtype

SEM, XRD and FT-IR after air exposure

2023 · Controllable Construction of Two-Dimensional Conductive M3(HHTP)2 Nanorods for Electrochemical Sensing of Malachite Green in Fish

Cu3(HHTP)2 nanorod powder · Powder · Cu3(HHTP)2 before and after 30 days exposure to air.

Diffraction StructurePowder

Powder XRD

2023 · Controllable Construction of Two-Dimensional Conductive M3(HHTP)2 Nanorods for Electrochemical Sensing of Malachite Green in Fish

Cu/Ni/Co M3(HHTP)2 nanorod powder series · Powder · Powder XRD patterns assigned to M3(HHTP)2 nanorod crystals.

Diffraction StructurePowder

PXRD / synchrotron PXRD

2023 · Cooperative Proton and Li-ion Conduction in a 2D-Layered MOF via Mechanical Insertion of Lithium Halides

Ti-dobdc pristine · Pellet · Powder X-ray diffraction patterns collected for pristine Ti-dobdc and LiX-loaded samples.

Diffraction StructurePowder

PXRD / synchrotron PXRD

2023 · Cooperative Proton and Li-ion Conduction in a 2D-Layered MOF via Mechanical Insertion of Lithium Halides

Ti-dobdc-LiBr (MOF:LiBr = 1:1) · Pellet · Powder X-ray diffraction patterns collected for pristine Ti-dobdc and LiX-loaded samples.

Diffraction StructurePowder

PXRD / synchrotron PXRD

2023 · Cooperative Proton and Li-ion Conduction in a 2D-Layered MOF via Mechanical Insertion of Lithium Halides

Ti-dobdc-LiCl (MOF:LiCl = 1:1) · Pellet · Powder X-ray diffraction patterns collected for pristine Ti-dobdc and LiX-loaded samples.

Diffraction StructurePowder

PXRD / synchrotron PXRD

2023 · Cooperative Proton and Li-ion Conduction in a 2D-Layered MOF via Mechanical Insertion of Lithium Halides

Ti-dobdc-LiI (MOF:LiI = 1:1) · Pellet · Powder X-ray diffraction patterns collected for pristine Ti-dobdc and LiX-loaded samples.

Diffraction StructurePowder

Powder X-ray diffraction using Cu Kalpha radiation

2023 · Copper(i) iodide coordination polymers with triazole substituted pyridine ligands: photophysical and electrical conductivity properties

CP1 bulk powder · Powder · Bulk sample PXRD compared with simulated PXRD from SC-XRD; 2theta range 5-50 degrees in SI methods

Diffraction StructurePowder

Powder X-ray diffraction using Cu Kalpha radiation

2023 · Copper(i) iodide coordination polymers with triazole substituted pyridine ligands: photophysical and electrical conductivity properties

CP2 bulk powder · Powder · Bulk sample PXRD compared with simulated PXRD from SC-XRD; 2theta range 5-50 degrees in SI methods

Diffraction StructurePowder

Powder X-ray diffraction using Cu Kalpha radiation

2023 · Copper(i) iodide coordination polymers with triazole substituted pyridine ligands: photophysical and electrical conductivity properties

CP3 bulk yellow powder · Powder · Bulk sample PXRD compared with simulated PXRD from SC-XRD; 2theta range 5-50 degrees in SI methods

Electrochemistry ApplicationPowder

RDE three-electrode OER/ORR LSV, CV, EIS and chronoamperometry; post-test SEM/TEM/PXRD/FT-IR

2023 · Copper-cobalt bimetallic conductive metal–organic frameworks as bifunctional oxygen electrocatalyst in alkaline and neutral media

CuCo-HITP/Nafion glassy-carbon working electrode · Electrode · Neutral 0.1 M PBS; oxygen-saturated for ORR/OER after O2 bubbling; LSV at 5 mV s-1; EIS 10^-2 to 10^5 Hz with +/-5 mV amplitude; potentials converted to RHE.

Diffraction StructurePowder

PXRD and TGA

2023 · Correlation in Structural Architecture toward Fabrication of Schottky Device with a Series of Pyrazine Appended Coordination Polymers

As-synthesised crystals/powder of 1 · Powder · PXRD with Cu Kalpha radiation, 1.548 A, room temperature; TGA 30-800 C at 10 C/min under N2.

Diffraction StructurePowder

PXRD and TGA

2023 · Correlation in Structural Architecture toward Fabrication of Schottky Device with a Series of Pyrazine Appended Coordination Polymers

As-synthesised crystals/powder of 2 · Powder · PXRD with Cu Kalpha radiation, 1.548 A, room temperature; TGA 30-800 C at 10 C/min under N2.

Diffraction StructurePowder

PXRD and TGA

2023 · Correlation in Structural Architecture toward Fabrication of Schottky Device with a Series of Pyrazine Appended Coordination Polymers

As-synthesised crystals/powder of 3 · Powder · PXRD with Cu Kalpha radiation, 1.548 A, room temperature; TGA 30-800 C at 10 C/min under N2.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Correlation in Structural Architecture toward Fabrication of Schottky Device with a Series of Pyrazine Appended Coordination Polymers

As-synthesised crystals/powder of 1 · Powder · Mo-Kalpha radiation, lambda = 0.71073 A; 273(2) K; Bruker APEX-II CCD; SHELX-97 refinement.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Correlation in Structural Architecture toward Fabrication of Schottky Device with a Series of Pyrazine Appended Coordination Polymers

As-synthesised crystals/powder of 2 · Powder · Mo-Kalpha radiation, lambda = 0.71073 A; 273 K; Bruker APEX-II CCD; SHELX-97 refinement.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Correlation in Structural Architecture toward Fabrication of Schottky Device with a Series of Pyrazine Appended Coordination Polymers

As-synthesised crystals/powder of 3 · Powder · Mo-Kalpha radiation, lambda = 0.71073 A; 273(2) K; Bruker APEX-II CCD; SHELX-97 refinement.

Diffraction StructureUnspecified subtype

XRD, SEM, HRTEM, elemental mapping, ICP, XPS

2023 · Creating Dual Active Sites in Conductive Metal-Organic Frameworks for Efficient Water Splitting

IrCo-CAT/CC nanorod arrays · Electrode · Characterisation of IrCo-CAT/CC and RhCo-CAT/CC analogues.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2023 · Creating Dual Active Sites in Conductive Metal-Organic Frameworks for Efficient Water Splitting

RuCo-CAT/CC nanorod arrays · Electrode · XRD comparison of Co-CAT/CC and RuCo-CAT/CC with simulated Co-CAT pattern.

Diffraction StructureUnspecified subtype

post-electrolysis XRD/SEM/HRTEM

2023 · Cu/Co bimetallic conductive MOFs: Electronic modulation for enhanced nitrate reduction to ammonia

Cu1Co1HHTP powder · Powder · Structure and morphology after cycling stability test

Diffraction StructurePowder

powder X-ray diffraction

2023 · Cu/Co bimetallic conductive MOFs: Electronic modulation for enhanced nitrate reduction to ammonia

CoHHTP powder · Powder · Powder XRD for phase/stacking assignment of serial HHTP MOFs

Diffraction StructurePowder

powder X-ray diffraction

2023 · Cu/Co bimetallic conductive MOFs: Electronic modulation for enhanced nitrate reduction to ammonia

Cu1Co1HHTP powder · Powder · Powder XRD for phase/stacking assignment of serial HHTP MOFs

Diffraction StructurePowder

powder X-ray diffraction

2023 · Cu/Co bimetallic conductive MOFs: Electronic modulation for enhanced nitrate reduction to ammonia

Cu1Co2HHTP powder · Powder · Powder XRD for phase/stacking assignment of serial HHTP MOFs

Diffraction StructurePowder

powder X-ray diffraction

2023 · Cu/Co bimetallic conductive MOFs: Electronic modulation for enhanced nitrate reduction to ammonia

Cu2Co1HHTP powder · Powder · Powder XRD for phase/stacking assignment of serial HHTP MOFs

Diffraction StructurePowder

powder X-ray diffraction

2023 · Cu/Co bimetallic conductive MOFs: Electronic modulation for enhanced nitrate reduction to ammonia

CuHHTP powder · Powder · Powder XRD for phase/stacking assignment of serial HHTP MOFs

Diffraction StructurePowder

SEM and powder X-ray diffraction

2023 · Decoupling Redox Hopping and Catalysis in Metal-Organic Frameworks -based Electrocatalytic CO2 Reduction

CoPc@NU-1000-h · Powder · PXRD range 1.5 < 2theta < 30 deg, 0.05 deg step, 2 deg/min; SEM on sputter-coated samples

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2023 · Diazo-reaction based dual-mode colorimetric-electrochemical sensing of nitrite in pickled food

Cu-MOFs component · Powder · XRD pattern of Cu-MOFs compared with AMTA.

Microscopy MorphologyUnspecified subtype

SEM/TEM/EDS elemental mapping and XRD

2023 · Dimensional Control of Highly Anisotropic and Transparent Conductive Coordination Polymers for Solution-Processable Large-Scale 2D Sheets

CuCl-(3,5DMP)TU 2D nanosheet · Nanosheet · Characterisation of linker-substituted CuCl-TU morphology and elemental distribution.

Microscopy MorphologyUnspecified subtype

SEM/TEM/EDS elemental mapping and XRD

2023 · Dimensional Control of Highly Anisotropic and Transparent Conductive Coordination Polymers for Solution-Processable Large-Scale 2D Sheets

CuCl-(ethyl)TU 2D sheet · Nanosheet · Characterisation of linker-substituted CuCl-TU morphology and elemental distribution.

Microscopy MorphologyUnspecified subtype

SEM/TEM/EDS elemental mapping and XRD

2023 · Dimensional Control of Highly Anisotropic and Transparent Conductive Coordination Polymers for Solution-Processable Large-Scale 2D Sheets

CuCl-(m-tolyl)TU 1D nanowire · Powder · Characterisation of linker-substituted CuCl-TU morphology and elemental distribution.

Microscopy MorphologyUnspecified subtype

SEM/TEM/EDS elemental mapping and XRD

2023 · Dimensional Control of Highly Anisotropic and Transparent Conductive Coordination Polymers for Solution-Processable Large-Scale 2D Sheets

CuCl-(methyl)TU 2D nanosheet · Nanosheet · Characterisation of linker-substituted CuCl-TU morphology and elemental distribution.

Microscopy MorphologyUnspecified subtype

SEM/TEM/EDS elemental mapping and XRD

2023 · Dimensional Control of Highly Anisotropic and Transparent Conductive Coordination Polymers for Solution-Processable Large-Scale 2D Sheets

CuCl-(propyl)TU 2D nanosheet · Nanosheet · Characterisation of linker-substituted CuCl-TU morphology and elemental distribution.

Microscopy MorphologyUnspecified subtype

SEM/TEM/EDS elemental mapping and XRD

2023 · Dimensional Control of Highly Anisotropic and Transparent Conductive Coordination Polymers for Solution-Processable Large-Scale 2D Sheets

CuCl-(tert-butyl)TU 2D nanosheet · Nanosheet · Characterisation of linker-substituted CuCl-TU morphology and elemental distribution.

OtherUnspecified subtype

Temperature-dependent XRD and TG/DTG

2023 · Dimensional Control of Highly Anisotropic and Transparent Conductive Coordination Polymers for Solution-Processable Large-Scale 2D Sheets

1D CuCl-TU polymer nanowire · Powder · Heat treatment XRD and thermogravimetry of CuCl-TU polymers/nanowires.

Diffraction StructureUnspecified subtype

XRD/SAED/TEM

2023 · Dimensional Control of Highly Anisotropic and Transparent Conductive Coordination Polymers for Solution-Processable Large-Scale 2D Sheets

2D CuCl-TU polymer nanosheet · Nanosheet · Calculated and experimental diffraction used to assign interlayer spacing and weak interlayer interactions.

Diffraction StructurePowderRefinement

powder X-ray diffraction with Rietveld refinement

2023 · Dominant Role of Hole Transport Pathway in Achieving Record High Photoconductivity in Two-Dimensional Metal–Organic Frameworks

Cu-HHTP dried powder · Powder · Rigaku Miniflex II, Cu K alpha; experimental and simulated PXRD compared with AA/AB stacking models.

Diffraction StructurePowder

powder X-ray diffraction compared with simulated pattern

2023 · Double advantages of 2D coordination polymer of coumarinyl-pyridyl Schiff base decorated Zn(II): The fabrication of Schottky device and Anti-carcinogenic activity

as-synthesised powdered Zn(II)-CP · Powder · As-synthesised Zn(II)-CP powder compared with single-crystal-derived simulated geometry.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker SMART APEX II, Mo Kalpha radiation

2023 · Double advantages of 2D coordination polymer of coumarinyl-pyridyl Schiff base decorated Zn(II): The fabrication of Schottky device and Anti-carcinogenic activity

Zn(II)-CP single crystal · Single Crystal · Brown block crystal, 0.13 x 0.09 x 0.05 mm3; Bruker SMART APEX II, Mo Kalpha radiation, lambda = 0.71073 Angstrom; SHELX-97, PLATON-99 and ORTEP-32 used.

Diffraction StructurePowder

Benchtop powder X-ray diffraction

2023 · Electrically conductive [Fe4S4]-based organometallic polymers

[Fe4S4Cl2(Me-NHC)] (1) powder · Powder · Bruker D2 Phaser, lambda = 1.5418 A; samples loaded into airtight specimen holder under N2.

Diffraction StructureGrazing incidence

Synchrotron grazing-incidence X-ray diffraction

2023 · Electrically conductive Pt-MOFs for acidic oxygen reduction: Optimized performance via altering conjugated ligands

Pt3(C12N6O6)2 MOF thin film on Si · Thin Film · 2D GIXD spectrum of Pt3(C12N6O6)2 MOF thin film on Si.

Diffraction StructurePowderRefinement

Powder XRD with Pawley refinement

2023 · Electrically conductive Pt-MOFs for acidic oxygen reduction: Optimized performance via altering conjugated ligands

Pt3(C12N9H3O3)2 MOF black powder · Powder · Rigaku RINT Ultima III; Pawley refinement using Reflex in MS modelling.

Diffraction StructurePowderRefinement

Powder XRD with Pawley refinement

2023 · Electrically conductive Pt-MOFs for acidic oxygen reduction: Optimized performance via altering conjugated ligands

Pt3(C12N12H6)2 MOF black powder · Powder · Rigaku RINT Ultima III; Pawley refinement using Reflex in MS modelling.

Diffraction StructurePowderRefinement

Powder XRD with Pawley refinement

2023 · Electrically conductive Pt-MOFs for acidic oxygen reduction: Optimized performance via altering conjugated ligands

Pt3(C12N6O6)2 MOF black powder · Powder · Rigaku RINT Ultima III; Pawley refinement using Reflex in MS modelling.

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement against DFT-optimised model

2023 · Electrically Conductive π-Intercalated Graphitic Metal-Organic Framework Containing Alternate π-Donor/Acceptor Stacks

iGMOF1 black powder · Powder · Cu Kalpha PXRD; Rietveld refinement in Rigaku SmartLab Studio; structural units treated as rigid bodies.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Electrically Conductive π-Intercalated Graphitic Metal-Organic Framework Containing Alternate π-Donor/Acceptor Stacks

Supramolecular [HATP/HCTP]n array powder/crystals · Powder · SCXRD of supramolecular [HATP/HCTP]n array; disordered solvent omitted by PLATON/SQUEEZE.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2023 · Elucidating d-π conjugated two-dimensional 2,3,6,7,10,11-hexahydroxytriphenylene based conductive metal-organic framework for hybrid supercapacitors

dark blue Ni3(HHTP)2 crystals · Powder · PXRD pattern compared with previously reported Ni3(HHTP)2-like structures

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Rietveld refinement

2023 · Engineering Band Gap and Photoconduction in Semiconducting Metal Organic Frameworks: Metal Node Effect

M-THQ powder series · Powder · PXRD patterns collected with Cu Kalpha radiation; Rietveld refinement in GSAS-II using modified cubic Fe-THQ unit cell for Fe, Ni, Zn; Cu assigned to 2D structure.

Diffraction StructurePowder

powder X-ray diffraction

2023 · Engineering defective trimetallic metal-organic framework nanosheets for advanced water oxidation electrocatalysis

NiFeZn MOF nanosheets · Nanosheet · comparison with NiFe MOF and JCPDS no. 035-1677

Diffraction StructurePowder

PXRD after CV cycling/OER

2023 · Enhanced cobalt MOF electrocatalyst for oxygen evolution reaction via morphology regulation

Co-MOF-C electrode after OER testing · Electrode · PXRD of Co-MOF-C after reaction

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2023 · Enhanced cobalt MOF electrocatalyst for oxygen evolution reaction via morphology regulation

Co-MOF-A powder · Powder · PXRD comparison of Co-MOF-A/B/C against simulated Co2(OH)2BDC pattern

Diffraction StructurePowder

Powder X-ray diffraction (D/MAX-3D diffractometer)

2023 · Enhancing the Photocatalytic Degradation Efficiency of Dyes of Copper-Based Metal-Organic Frameworks through a Dimension-Induced Structural Strategy

Complex 1 reddish-brown acicular crystals · Single Crystal · PXRD patterns compared with simulated patterns for complexes 1-3

Diffraction StructurePowder

PXRD after solvent/acid/base soaking

2023 · Exceptionally high charge mobility in phthalocyanine-based poly(benzimidazobenzophenanthroline)-ladder-type two-dimensional conjugated polymers

2DCP-CuPc powder · Powder · Soaked at room temperature for 24 h in acetone, ethanol, tetrahydrofuran, dimethylformamide, 0.5 M H2SO4 and 1.0 M NaOH; PXRD recorded in reflection geometry.

Diffraction StructurePowderRefinement

Powder X-ray diffraction and Pawley refinement

2023 · Exceptionally high charge mobility in phthalocyanine-based poly(benzimidazobenzophenanthroline)-ladder-type two-dimensional conjugated polymers

2DCP-CuPc powder · Powder · Cu-Kalpha radiation; transmission geometry; room temperature; Pawley refinement over ca. 2.5-40 deg 2theta.

Diffraction StructurePowderRefinement

Powder X-ray diffraction and Pawley refinement

2023 · Exceptionally high charge mobility in phthalocyanine-based poly(benzimidazobenzophenanthroline)-ladder-type two-dimensional conjugated polymers

2DCP-NiPc powder · Powder · Cu-Kalpha radiation; transmission geometry; room temperature; Pawley refinement over ca. 2.5-40 deg 2theta.

Microscopy MorphologyUnspecified subtype

SEM and thin-film XRD

2023 · Experimental manifestation of redox-conductivity in metal-organic frameworks and its implication for semiconductor/insulator switching

UU-100(Co) thin film on FTO · Thin Film · SEM top and cross-section images plus thin-film XRD for UU-100(Co) on FTO.

Diffraction StructureUnspecified subtype

Thin-film X-ray diffraction and structural modelling

2023 · Experimental manifestation of redox-conductivity in metal-organic frameworks and its implication for semiconductor/insulator switching

Zn(pyrazol-NDI) thin film on FTO · Thin Film · Experimental thin-film XRD on FTO compared with simulated powder XRD; structure reconstructed based on reported structure.

Microscopy MorphologyUnspecified subtype

SEM and thin-film XRD

2023 · Experimental manifestation of redox-conductivity in metal-organic frameworks and its implication for semiconductor/insulator switching

Zr(dcphOH-NDI) thin film on FTO · Thin Film · SEM top and cross-section images plus thin-film XRD for Zr(dcphOH-NDI) on FTO.

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2023 · Framework Dimensional Control Boosting Charge Storage in Conjugated Coordination Polymers

as-synthesised 1D-CuTABQ powder · Powder · Cu Kalpha radiation, room temperature; DFT-optimised structure refined against PXRD

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2023 · Framework Dimensional Control Boosting Charge Storage in Conjugated Coordination Polymers

as-synthesised 2D-CuTABQ powder · Powder · Cu Kalpha radiation, room temperature; DFT-optimised structure refined against PXRD

SpectroscopyPowder

FTIR and PXRD phase identification

2023 · From non-conductive MOF to proton-conducting metal-HOFs: a new class of reversible transformations induced by solvent-free mechanochemistry

Mn-HOF-FA powder · Powder · Room-temperature PXRD and ATR-FTIR after liquid-assisted grinding of JUK-1 with CH(NH2)2SCN

SpectroscopyPowder

FTIR and PXRD phase identification

2023 · From non-conductive MOF to proton-conducting metal-HOFs: a new class of reversible transformations induced by solvent-free mechanochemistry

Mn-HOF-MA powder · Powder · Room-temperature PXRD and ATR-FTIR after liquid-assisted grinding of JUK-1 with CH3NH3SCN

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Rietveld refinement; CIF

2023 · From non-conductive MOF to proton-conducting metal-HOFs: a new class of reversible transformations induced by solvent-free mechanochemistry

Mn-HOF-FA powder · Powder · PANalytical X'Pert PRO MPD, Cu source, Debye-Scherrer geometry, 4-90 deg 2theta, 20 h collection

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Rietveld refinement

2023 · From non-conductive MOF to proton-conducting metal-HOFs: a new class of reversible transformations induced by solvent-free mechanochemistry

Mn-HOF-MA powder · Powder · PANalytical X'Pert PRO MPD, Cu source, Debye-Scherrer geometry, 4-90 deg 2theta, 21 h 40 min collection

Diffraction StructurePowderGrazing incidence

GIWAXS/PXRD structural assignment

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

Cu1.0 P0.1-20C · Thin Film · Hexagonal Cu-HHTP structure and face-on orientation from GIWAXS profiles/images.

Diffraction StructureGrazing incidence

GIWAXS orientation analysis

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

Cu0.1 P2.0-20C · Thin Film · Edge-on/a-b oriented Cu-HHTP from in-plane/out-of-plane profiles and GIWAXS image.

Diffraction StructureGrazing incidence

operando GIWAXS under RH air

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

edge-on Cu0.1 P2.0-20C-on-Cu-BTC-10C · Thin Film · Edge-on Cu0.1 P2.0-20C-on-Cu-BTC exposed to dry air and RH air at RT.

Diffraction StructureGrazing incidence

operando GIWAXS under RH air

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

face-on Cu-HHTP-40C-on-Cu-BTC-10C · Thin Film · Face-on Cu-HHTP-on-Cu-BTC thin film exposed to dry air and 70% RH air at RT.

Diffraction StructureGrazing incidence

grazing-angle GIWAXS

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

face-on Cu-HHTP-40C-on-Cu-BTC-10C · Thin Film · Depth-sensitive GIWAXS of MoM bilayers/trilayers from 0.06 to 0.50 degrees.

Diffraction StructureGrazing incidence

operando GIWAXS-Sensor with simultaneous resistance

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

Cu0.1 P2.0-20C · Thin Film · Dry air, 30% RH and 70% RH air at RT; edge-on a/b lattice softness tracked.

Diffraction StructureGrazing incidence

operando GIWAXS-Sensor

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

Cu0.1 P0.1-30C · Thin Film · Dry/RH air exposure at RT for face-on Cu0.1 P0.1-30C.

Diffraction StructureGrazing incidence

operando GIWAXS-Sensor with simultaneous resistance

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

Cu1.0 P0.1-20C · Thin Film · Dry air/RH air exposure at RT under DC bias; lattice expansion and conductivity decrease tracked.

Diffraction StructurePowder

in-situ synchrotron PXRD

2023 · Growth mechanisms and anisotropic softness-dependent conductivity of orientation-controllable metal-organic framework nanofilms

Cu-HHTP nanocrystals · Powder · Cu-HHTP nanocrystals under vacuum and 100% RH air at RT.

Diffraction StructurePowder

Powder X-ray diffraction / PXRD

2023 · Hierarchical conductive metal-organic framework films enabling efficient interfacial mass transfer

Zn-HHTP-H film on Si/SiO2 · Thin Film · Room-temperature PXRD using Cu-Kalpha radiation; time-dependent ZIF-8-to-Zn-HHTP transformation tracked.

Diffraction StructurePowder

PXRD before/after heating

2023 · Highly conductive three-dimensional metal organic frameworks from small in situ generated ligands

d-Co-F deguested pressed pellet · Pellet · PXRD after thermal guest-removal treatment; Co-F after heating shown in SI

Diffraction StructurePowder

PXRD before/after heating

2023 · Highly conductive three-dimensional metal organic frameworks from small in situ generated ligands

d-Mn-F deguested pressed pellet · Pellet · PXRD after thermal guest-removal treatment; Mn-F after heating shown in SI

Diffraction StructurePowder

PXRD before/after heating

2023 · Highly conductive three-dimensional metal organic frameworks from small in situ generated ligands

d-Ni-F deguested pressed pellet · Pellet · PXRD after thermal guest-removal treatment; Ni-F after heating shown in SI

Diffraction StructurePowderSingle crystal

Single-crystal/powder XRD structure assignment

2023 · Highly conductive three-dimensional metal organic frameworks from small in situ generated ligands

Ni-F as-synthesised crystals · Single Crystal · Paper describes Ni-F as isostructural, but no Ni-F CIF or SI crystallographic table row was supplied in the assigned documents.

Diffraction StructurePowder

PXRD and TGA

2023 · In Situ Oxidation of Pyridyl-Dihydrobenzoimidazoquinazoline and the Synthesis of a Highly Luminescent Cd(II) Coordination Polymer: A Promising Candidate for Mutagenic Nitroaromatic Detection and Device Fabrication

As-synthesised bulk compound 1 · Powder · PXRD at room temperature; TGA from 30 to 800 degree C in N2 at 10 degree C/min; additional PXRD after pH=4 immersion, TNP immersion, and 50 degree C heating.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SC-XRD), Bruker APEX-II diffractometer, Mo Kalpha radiation, CCD detector; SADABS, SAINT, SHELXL, Apex III, Olex2, SHELXT

2023 · In Situ Oxidation of Pyridyl-Dihydrobenzoimidazoquinazoline and the Synthesis of a Highly Luminescent Cd(II) Coordination Polymer: A Promising Candidate for Mutagenic Nitroaromatic Detection and Device Fabrication

Block-like yellow crystals of compound 1 · Single Crystal · Crystal removed from mother liquor, covered with paratone oil, mounted on MiteGen loop; hkl range -10 <= h <= 10, -11 <= k <= 11, -35 <= l <= 35.

Diffraction StructurePowder

powder X-ray diffraction

2023 · Iodine uptake enhanced electrical conductivity by a metal-organic framework bearing nanotube array of π-stacked columns

compound 1 crystals · Single Crystal · PXRD patterns obtained on a Rigaku 2100 diffractometer using Cu-Kalpha radiation with flat plate geometry

Diffraction StructureUnspecified subtype

postmortem X-ray diffraction after LSV

2023 · Ionic Liquid-Laden Zn-MOF-74-Based Solid-State Electrolyte for Sodium Batteries

IL0.5@MOF (0.5:1) · Pellet · Diffractograms of IL0.5@MOF as prepared and after LSV to 7 V vs Na+/Na

Diffraction StructurePowderRefinement

PXRD with pattern matching refinement

2023 · Ionic Liquid-Laden Zn-MOF-74-Based Solid-State Electrolyte for Sodium Batteries

Zn-MOF-74 powder · Powder · Cu Kalpha radiation, 5 < 2theta < 70 deg, step size 0.028 deg, acquisition 1 s per step at 25 deg C; R-3 spatial group and single-crystal cell parameters used

Diffraction StructureUnspecified subtype

X-ray diffraction spectroscopy (XRD)

2023 · Isonicotinic acid-based copper-MOF: An exotic redox propertied electrode material for high energy asymmetric supercapacitor

Sky blue Cu-MOF crystals · Powder · D/Max-3c X-ray diffractometer (Rigaku, Japan) using Mo-Kalpha radiation, lambda = 0.71073 A.

Diffraction StructureUnspecified subtype

SEM, EDX, XRD; FT-IR in Fig. S32

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Co3(HHTP)2 film on Au electrode · Thin Film · Co3(HHTP)2 film deposited on Au electrode at 0.3 V for 60 min.

Electrochemistry ApplicationUnspecified subtype

Ag electroplating test, SEM/EDX/XRD

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Ag-electroplated Cu3(HHTP)2 film electrode · Electrode · Cu3(HHTP)2 film used as an electrode for electroplating Ag from 0.05 M AgNO3 at -0.1 V for 1 min.

Diffraction StructureUnspecified subtype

SEM and XRD

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Cu3(HHTP)2 film on FTO electrode · Thin Film · Cu3(HHTP)2 film deposited on FTO electrode at 0.25 V.

Microscopy MorphologyUnspecified subtype

SEM, AFM and XRD over deposition time

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Cu3(HHTP)2 Au-film growth kinetics series · Thin Film · Potentiostatic deposition at 0.25 V for 5 s to 10 h on Au electrodes.

Diffraction StructureUnspecified subtype

SEM and XRD

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Cu3(HHTP)2 film on HOPG electrode · Thin Film · Cu3(HHTP)2 film deposited on HOPG electrode at 0.25 V.

Diffraction StructureUnspecified subtype

SEM and XRD

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Cu3(HHTP)2 film on ITO electrode · Thin Film · Cu3(HHTP)2 film deposited on ITO electrode at 0.25 V.

Microscopy MorphologyUnspecified subtype

SEM and XRD of PCTE-template nanorods

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Cu3(HHTP)2 nanorods grown in Au-coated PCTE membrane · Electrode · Cu3(HHTP)2 growth confined in Au-coated PCTE membrane; released after PCTE dissolution.

Diffraction StructureUnspecified subtype

SEM and XRD

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Cu3(HHTP)2 film on silicon electrode · Thin Film · Cu3(HHTP)2 film deposited on silicon electrode at 0.25 V.

Diffraction StructureUnspecified subtype

SEM and XRD

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Solvothermally grown Cu3(HHTP)2 film on Au electrode · Thin Film · Solvothermally grown Cu3(HHTP)2 film on Au electrode.

Diffraction StructureUnspecified subtype

SEM and XRD; FT-IR in Fig. S38

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Cu2TBA film on Au electrode · Thin Film · Cu2TBA film deposited on Au electrode at 0.3 V for 60 min.

Diffraction StructureUnspecified subtype

In-plane and out-of-plane XRD; rocking curve; pole figure

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Cu3(HHTP)2 film on Au/Cr/glass anode deposited at 0.25 V for 45 min · Thin Film · Cu3(HHTP)2 film on Au electrode after 0.25 V, 45 min deposition.

Diffraction StructureUnspecified subtype

SEM and XRD; FT-IR in Fig. S35

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

YbHHTP film on Au electrode · Thin Film · YbHHTP film deposited on Au electrode at 0.25 V for 60 min.

Diffraction StructureUnspecified subtype

SEM, EDX, XRD; FT-IR in Fig. S29

2023 · Ligand-Oxidation-Based Anodic Synthesis of Oriented Films of Conductive M-Catecholate Metal-Organic Frameworks with Controllable Thickness

Zn3(HHTP)2 film on Au electrode · Thin Film · Zn3(HHTP)2 film deposited on Au electrode at 0.3 V for 30 min.

Diffraction StructurePowderRefinement

Synchrotron PXRD with Pawley refinement

2023 · Linker-Based Bandgap Tuning in Conductive MOF Solid Solutions

Cu3(TATHB)2 / Cu-TATHB (x = 0) · Pellet · Beamline 17-BM, Advanced Photon Source; lambda = 0.45237 A; fitted against AA eclipsed, slipped, and staggered models.

Diffraction StructurePowder

Synchrotron PXRD

2023 · Linker-Based Bandgap Tuning in Conductive MOF Solid Solutions

Cu3(HAB)(TATHB) · Pellet · PXRD used to confirm phase retention across solid-solution compositions.

Diffraction StructurePowder

PXRD of THQ-containing control attempts

2023 · Linker-Based Bandgap Tuning in Conductive MOF Solid Solutions

THQ mixed-ligand control attempts · Powder · Cu3(HAB)x(THQ)2-x and Cu3(TATHB)x(THQ)2-x attempts under ambient, inert, and inert/ethylenediamine conditions; lambda = 1.5418 A.

Diffraction StructureUnspecified subtype

X-ray diffraction

2023 · Metal-Organic Framework Glass Catalysts from Melting Glass-Forming Cobalt-Based Zeolitic Imidazolate Framework for Boosting Photoelectrochemical Water Oxidation

10% Co-agZIF-62 glass · Powder · XRD comparison of 10% Co-ZIF-62 crystal and Co-agZIF-62 glass

Diffraction StructurePowder

High-resolution synchrotron XRD/PXRD

2023 · Microscopic Origin of Electrochemical Capacitance in Metal-Organic Frameworks

Cu3(HHTP)2 powder · Powder · Samples in borosilicate capillaries sealed in N2-filled glovebox; Diamond I11 beamline; wavelength 0.82683 A.

Diffraction StructureUnspecified subtype

XRD with Cu-Kalpha radiation and XPS

2023 · Microwave discharge for rapid introduction of bimetallic-synergistic configuration to conductive catecholate toward long-term supercapacitor

Zn,Ni-CAT-T4 · Electrode · XRD measured at 40 kV and 40 mA; XPS used to analyse surface species and chemical states.

Diffraction StructurePowder

Powder XRD ageing stability comparison

2023 · MOF-Assimilated High-Sensitive Organic Field-Effect Transistors for Rapid Detection of a Chemical Warfare Agent

as-synthesised CPO-27-Ni powder/crystals · Powder · PXRD of as-synthesised CPO-27-Ni and CPO-27-Ni after rigorous use/exposure for 2 years in ambient atmosphere.

Diffraction StructurePowder

Powder XRD and structural assignment

2023 · MOF-Assimilated High-Sensitive Organic Field-Effect Transistors for Rapid Detection of a Chemical Warfare Agent

as-synthesised CPO-27-Ni powder/crystals · Powder · Powder XRD collected at ambient temperature with scan speed 1 deg/min, step size 0.02 deg in 2theta, 2theta range 5-40 deg.

Diffraction StructureUnspecified subtype

Thin-film XRD

2023 · MOF-Assimilated High-Sensitive Organic Field-Effect Transistors for Rapid Detection of a Chemical Warfare Agent

CPO-27-Ni/pentacene bilayer OFET, 3000 rpm MOF coating · Thin Film · Thin-film XRD under ambient conditions, 2theta 4-20 deg at 2 deg/min, comparing pristine pentacene and CPO-27-Ni spin-coated bilayer films.

Diffraction StructurePowder

Powder X-ray diffraction

2023 · Near IR Bandgap Semiconducting 2D Conjugated Metal-Organic Framework with Rhombic Lattice and High Mobility

Cu2(OHPTP) bulk powder · Powder · STOE STADI P diffractometer, Cu Kalpha 1.54 Angstrom radiation at room temperature.

SpectroscopyUnspecified subtype

Post-soaking XRD, N2 adsorption, and FT-IR

2023 · Negative electrodes for supercapacitors with good performance using conductive bismuth-catecholate metal-organic frameworks

Bi(HHTP) 12 h nanobelts · Powder · Bi(HHTP) 12 h soaked in 3 M KOH; XRD, N2 adsorption, and FT-IR compared before/after soaking.

Electrochemistry ApplicationUnspecified subtype

SI XRD impurity estimate and GCD control

2023 · Negative electrodes for supercapacitors with good performance using conductive bismuth-catecholate metal-organic frameworks

0.25Bi(C2H3O2)3:Bi(HHTP) 12 h mixture electrode · Electrode · Bi(C2H3O2)3, Bi(HHTP) 12 h, and 0.25:1 Bi(C2H3O2)3:Bi(HHTP) 12 h electrodes compared at 1 A g^-1.

Diffraction StructurePowder

Aqueous dispersion observation and PXRD after soaking in Milli-Q water

2023 · Novel aptasensing strategy for efficiently quantitative analyzing Staphylococcus aureus based on defective copper-based metal–organic framework

nattier blue ML-Cu2O@Cu-MOF powder · Powder · 10 mg MOF dispersed in 10 mL Milli-Q water by ultrasonication for 0.5 h to form 1 mg mL-1 suspension; suspension stood for 1 h; refreshed by rocking flask for 2 min; PXRD measured after water exposure for 1, 3 and 7 days.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2023 · Novel aptasensing strategy for efficiently quantitative analyzing Staphylococcus aureus based on defective copper-based metal–organic framework

nattier blue ML-Cu2O@Cu-MOF powder · Powder · PXRD comparison of Cu-BDC, Cu-H3BTC, Cu-H4EBTC, and ML-Cu2O@Cu-MOF powders.

Diffraction StructureUnspecified subtype

X-ray diffraction

2023 · Novel insights of structure evolution between ZIF and hydroxide via controlled doses of ammonium bifluoride and applications on battery supercapacitor hybrids

M-H10 powder · Nanosheet · XRD patterns for M-H2, M-H5, M-H10, M-H15 and M-H20 compared with ZIF-L-Co, Co(OH)2 and Ni(OH)2 references.

Diffraction StructurePowder

Powder X-ray diffraction using Cu Kalpha radiation

2023 · One-Dimensional π-d Conjugated Conductive Metal-Organic Framework with Dual Redox-Active Sites for High-Capacity and Durable Cathodes for Aqueous Zinc Batteries

Cu-BTA-H powder · Powder · XRD patterns of Cu-BTA-H, Cu-BTA-L and Ni-BTA-H powders compared with reported BTA-based c-MOF patterns.

Diffraction StructureUnspecified subtype

out-of-plane and in-plane X-ray diffraction

2023 · Orientation Control of a Two-Dimensional Conductive Metal-Organic Framework Thin Film by a Pyridine Vapor-Assisted Dry Process

as-deposited Cu3(HHTP)2-like thin film on alpha-Al2O3 (001) · Thin Film · SI XRD patterns of as-deposited Cu3(HHTP)2 thin film on alpha-Al2O3 (001).

Diffraction StructureUnspecified subtype

SEM and XRD of processed electrodes

2023 · Overcoming Diffusion Limitation of Faradaic Processes: Property-Performance Relationships of 2D Conductive Metal-Organic Framework Cu3(HHTP)2 for Reversible Lithium-Ion Storage

Flake-like Cu3(HHTP)2 composite electrode · Electrode · SEM and XRD before/after electrode processing; electrodes contain 60 wt% active material and 40 wt% amorphous carbon/binder.

Diffraction StructureUnspecified subtype

Post-cycling XRD stability comparison in LiPF6 and LiTFSI electrolytes

2023 · Overcoming Diffusion Limitation of Faradaic Processes: Property-Performance Relationships of 2D Conductive Metal-Organic Framework Cu3(HHTP)2 for Reversible Lithium-Ion Storage

Flake-like Cu3(HHTP)2 composite electrode · Electrode · Rod-like and flake-like Cu3(HHTP)2 electrodes after 100 cycles at 100 mA g-1 in 1 M LiPF6 or 1 M LiTFSI in EC:EMC 3:7.

Diffraction StructureUnspecified subtype

In situ XRD during cyclic voltammetry

2023 · Overcoming Diffusion Limitation of Faradaic Processes: Property-Performance Relationships of 2D Conductive Metal-Organic Framework Cu3(HHTP)2 for Reversible Lithium-Ion Storage

Flake-like Cu3(HHTP)2 composite electrode · Electrode · Self-designed in situ cell; electrode on Be disc; Li metal negative electrode; Whatman separator with 200 uL electrolyte; 0.05 mV s-1, 1.7-3.5 V; XRD 8-35 deg 2theta with 90 min scans.

Diffraction StructurePowderRefinement

PXRD with LeBail refinement

2023 · Overcoming Diffusion Limitation of Faradaic Processes: Property-Performance Relationships of 2D Conductive Metal-Organic Framework Cu3(HHTP)2 for Reversible Lithium-Ion Storage

Flake-like Cu3(HHTP)2 powder activated at 60 C · Powder · PXRD 4-40 deg 2theta, 0.01 deg step, Cu-Kalpha radiation; LeBail refinement with FullProf based on eclipsed stacking model.

Diffraction StructurePowderRefinement

PXRD with LeBail refinement

2023 · Overcoming Diffusion Limitation of Faradaic Processes: Property-Performance Relationships of 2D Conductive Metal-Organic Framework Cu3(HHTP)2 for Reversible Lithium-Ion Storage

Rod-like Cu3(HHTP)2 powder activated at 60 C · Powder · PXRD 4-40 deg 2theta, 0.01 deg step, Cu-Kalpha radiation; LeBail refinement with FullProf based on tilted stacking model.

OtherPowder

Thermogravimetric analysis and PXRD residue check

2023 · Overcoming Diffusion Limitation of Faradaic Processes: Property-Performance Relationships of 2D Conductive Metal-Organic Framework Cu3(HHTP)2 for Reversible Lithium-Ion Storage

Flake-like Cu3(HHTP)2 powder activated at 60 C · Powder · TGA 30-650 C at 10 C min-1 under oxygen flow; flake-like samples pre-dried under <0.05 mbar for 20 h at RT, 60, 80 or 120 C.

SpectroscopyPowder

Ex situ PXRD, FTIR and XPS after charge/discharge

2023 · Oxidatively Doped Tetrathiafulvalene-Based Metal-Organic Frameworks for High Specific Energy of Supercapatteries

1-ox electrode · Electrode · Fully discharged and fully charged 1-ox positrode states after cycling; includes C 1s, N 1s, S 2p and Ni 2p XPS.

Diffraction StructurePowder

Powder X-ray diffraction

2023 · Oxidatively Doped Tetrathiafulvalene-Based Metal-Organic Frameworks for High Specific Energy of Supercapatteries

1-ox · Single Crystal · PXRD of 1/1-ox and 2/2-ox compared with simulated patterns.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Oxidatively Doped Tetrathiafulvalene-Based Metal-Organic Frameworks for High Specific Energy of Supercapatteries

1 crystals · Single Crystal · Representative crystal structure; refinement parameters in missing Table S1/CIF.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Oxidatively Doped Tetrathiafulvalene-Based Metal-Organic Frameworks for High Specific Energy of Supercapatteries

2 crystals · Single Crystal · Isostructural with 1; refinement parameters in missing Table S1/CIF.

Diffraction StructurePowder

Powder X-ray diffraction

2023 · Partial selenium surface modulation of metal organic framework assisted cobalt sulfide hollow spheres for high performance bifunctional oxygen electrocatalysis and rechargeable zinc-air batteries

Se-doped MOF CoS2 hollow spheres · Powder · Rigaku Cu-K source radiation, scan rate 2 deg min-1; comparison of MOF CoS2 and Se-doped MOF CoS2 hollow spheres.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2023 · Piperazine-linked metal covalent organic framework-coated fibers for efficient electro-enhanced solid-phase microextraction of chlorophenols

CuPc-MCOF powder · Powder · Ultima IV diffractometer; scan range 1.5-35 deg; scan rate 5 deg min-1.

SpectroscopyUnspecified subtype

FT-IR and XRD after solvent/acid/base soaking

2023 · Piperazine-linked metal covalent organic framework-coated fibers for efficient electro-enhanced solid-phase microextraction of chlorophenols

CuPc-MCOF powder · Powder · CuPc-MCOF soaked for 72 h in 6 M HCl, 6 M NaOH, MeOH, DMF and DCM; washed/dried material examined by FT-IR and XRD.

Diffraction StructureUnspecified subtype

XRD, Cu K-alpha radiation

2023 · Preparation of hierarchical MOF-5 films using morphology controlled ZnO coatings for temperature dependent optical sensors application

MOF-5/ZnO nanorod hybrid thin film · Thin Film · XRD phase assignment for MOF-5/ZnO hybrid film and Table 1 lattice parameters

Diffraction StructureUnspecified subtype

XRD, Cu K-alpha radiation

2023 · Preparation of hierarchical MOF-5 films using morphology controlled ZnO coatings for temperature dependent optical sensors application

ZnO nanorod thin film · Thin Film · XRD from 10-60 deg, 40 keV, 30 mA

Diffraction StructurePowderSingle crystal

powder X-ray diffraction compared with simulated single-crystal pattern

2023 · Pyridyl-Isonicotinoyl Hydrazone-Bridged Zn(II) Coordination Framework with Thiophenedicarboxylato Link: Structure, Biological Activity, and Electrical Conductivity

finely ground/as-synthesised compound 1 powder · Powder · Room-temperature PXRD using Cu microfocus tube (lambda = 1.54178 A, 40 kV, 40 mA) for as-synthesised and condition-exposed compound 1, compared with simulated pattern in SI Figures S3 and S8.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2023 · Pyridyl-Isonicotinoyl Hydrazone-Bridged Zn(II) Coordination Framework with Thiophenedicarboxylato Link: Structure, Biological Activity, and Electrical Conductivity

block-shaped yellow crystals of compound 1 · Single Crystal · Structure solution for compound 1; CCDC 2194333; SI Table S1 reports Mo Kalpha radiation, 273(2) K, monoclinic P21/n cell and refinement statistics; SI Table S2 lists selected bond lengths/angles.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD, Bruker D8 Advance)

2023 · Reconstruction of Co/Ni metal-organic-framework based electrode materials with excellent conductivity and integral stability via extended hydrothermal treatment toward improved performance of supercapacitors

Co/Ni-MOF@CC-12 · Electrode · XRD patterns of Co/Ni-MOF@CC-6, Co/Ni-MOF@CC-12 and Co/Ni-MOF@CC-18 on carbon cloth.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2023 · Redox-Active Mixed-Linker Metal–Organic Frameworks with Switchable Semiconductive Characteristics for Tailorable Chemiresistive Sensing

Mn2[TTF]x[NiS4]1-x powder series · Powder · Room-temperature PXRD; Cu radiation; scan speed 0.1 s/step; solvent/vapour stability tests on Mn2[TTF]0.49[NiS4]0.51.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; Bruker D8 Venture / PHOTON-100 CMOS, Mo Kalpha; SHELXTL refinement with PLATON SQUEEZE

2023 · Redox-Active Mixed-Linker Metal–Organic Frameworks with Switchable Semiconductive Characteristics for Tailorable Chemiresistive Sensing

Mn2[TTF]0.49[NiS4]0.51 single crystal · Single Crystal · Data collected under nitrogen cryoflow at 193 K according to SI methods; Table S1 reports refinement parameters at 296.15 K in the table/CIF.

Diffraction StructurePowder

powder X-ray diffraction

2023 · Redox-Active Two-Dimensional Tetrathiafulvalene-Copper Metal-Organic Framework with Boosted Electrochemical Performances for Supercapatteries

Iodine-treated crystals of 1 (1-ox) · Single Crystal · PXRD comparison of simulated 1 and experimental 1, 1-ox' and 1-ox patterns.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2023 · Redox-Active Two-Dimensional Tetrathiafulvalene-Copper Metal-Organic Framework with Boosted Electrochemical Performances for Supercapatteries

Maroon single crystals of 1 · Single Crystal · Crystal data collected on Bruker APEX-II CCD at 120 K; SHELXS/SHELXL refinement.

Diffraction StructurePowder

PXRD, FT-IR, XPS

2023 · Regulating Crystallization and Lead Leakage of Perovskite Solar Cell Via Novel Polyoxometalate-Based Metal–Organic Framework

POMOF reddish-brown block crystals · Single Crystal · Simulated/experimental PXRD, FTIR and survey/high-resolution XPS used to verify crystalline POMOF.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2023 · Regulating Crystallization and Lead Leakage of Perovskite Solar Cell Via Novel Polyoxometalate-Based Metal–Organic Framework

POMOF reddish-brown block crystals · Single Crystal · Mo-Ka radiation, 296(2) K; refined with SHELXTL-2014

Diffraction StructureGrazing incidence

In situ TG-FTIR, XRD, UV-vis and GIWAXS

2023 · Regulating Crystallization and Lead Leakage of Perovskite Solar Cell Via Novel Polyoxometalate-Based Metal–Organic Framework

POMOF-functionalised perovskite film · Thin Film · Perovskite precursor with/without POMOF heated at 100 degC for 1 h under N2; in situ XRD annealing sequence 0-3600 s; GIWAXS after 60 min anneal.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2023 · Ruthenium(II) complex-grafted conductive metal-organic frameworks with conductivity- and confinement-enhanced electrochemiluminescence for ultrasensitive biosensing application

Ru@Ni3(HITP)2 powder · Powder · PXRD patterns of Ni3(HITP)2 and Ru@Ni3(HITP)2 compared with simulated Ni3(HITP)2 pattern.

Microscopy MorphologyUnspecified subtype

SEM and XRD of Cu-HHTP NP-Cu

2023 · Self-Powered Disinfection Using Triboelectric, Conductive Wires of Metal-Organic Frameworks

Cu-HHTP NP-Cu electrode · Electrode · Nanoparticle-modified copper mesh morphology and phase assignment.

Diffraction StructureUnspecified subtype

X-ray diffraction

2023 · Self-Powered Disinfection Using Triboelectric, Conductive Wires of Metal-Organic Frameworks

Cu-HHTP NW-Cu electrode · Electrode · XRD pattern of Cu-HHTP NW-Cu electrode compared with simulated Cu-HHTP and Cu(OH)2 precursor.

Diffraction StructureUnspecified subtype

XRD and selected-area electron diffraction (SAED)

2023 · Self-Powered Infrared Photodetectors with Ultra-High Speed and Detectivity Based on Amorphous Cu-Based MOF Films

p-a-Cu-HHTP MOF film on electrospun nanofibres · Thin Film · Phase/crystallinity assessment of p-a-Cu-HHTP MOF film.

Diffraction StructurePowder

powder X-ray diffraction (Bruker D8 Advance)

2023 · Self-supporting electrocatalyst constructed from in-situ transformation of Co(OH)2 to metal-organic framework to Co/CoP/NC nanosheets for high-current-density water splitting

Co/CoP/NC/CoF-550 / 6 h · Electrode · XRD patterns of Co(OH)2/CoF, Co-MOF/CoF and Co/CoP/NC/CoF.

Diffraction StructurePowder

PXRD with Le Bail fitting

2023 · Stabilizing Redox-Active Hexaazatriphenylene in a 2D Conductive Metal–Organic Framework for Improved Lithium Storage Performance

Cu-HATN powder · Powder · Powder X-ray diffraction; Cu K alpha radiation; AA-stacked simulated structure compared with experiment.

Diffraction StructurePowder

TGA, variable-temperature PXRD, soaking PXRD

2023 · Stabilizing Redox-Active Hexaazatriphenylene in a 2D Conductive Metal–Organic Framework for Improved Lithium Storage Performance

Cu-HATN powder · Powder · TGA under N2 at 10 deg C min^-1; PXRD before/after 24 h soaking in carbonate electrolyte or water; variable-temperature PXRD.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2023 · Strategies to enhance electrochemical performance of isoreticular 2d conjugated metal correlated organic frameworks via transition metals intercalation for battery-supercapacitor hybrids

As-synthesised Cu-MOF crystals/powder · Powder · XRD pattern compared with previously reported patterns.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2023 · Strategies to enhance electrochemical performance of isoreticular 2d conjugated metal correlated organic frameworks via transition metals intercalation for battery-supercapacitor hybrids

As-synthesised Ni-MOF crystals/powder · Powder · XRD pattern compared with previously reported patterns.

Diffraction StructurePowder

Powder X-ray diffraction

2023 · Structures and electrical conductivities of a series of coordination polymers based on tetrathiafulvalene

Complex 1 bulk powdered sample · Powder · Rigaku 2100 diffractometer using Cu Kalpha radiation with flat-plate geometry

Diffraction StructurePowder

Powder X-ray diffraction

2023 · Structures and electrical conductivities of a series of coordination polymers based on tetrathiafulvalene

Complex 2 bulk powdered sample · Powder · Rigaku 2100 diffractometer using Cu Kalpha radiation with flat-plate geometry

Diffraction StructurePowder

Powder X-ray diffraction

2023 · Structures and electrical conductivities of a series of coordination polymers based on tetrathiafulvalene

Complex 3 bulk powdered sample · Powder · Rigaku 2100 diffractometer using Cu Kalpha radiation with flat-plate geometry

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Structures and electrical conductivities of a series of coordination polymers based on tetrathiafulvalene

Complex 1 single crystals · Single Crystal · Bruker D8 APEX III CCD, Mo Kalpha radiation, 200 K; SHELXL/Olex2 refinement

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Structures and electrical conductivities of a series of coordination polymers based on tetrathiafulvalene

Complex 2 single crystals · Single Crystal · XtaLAB Synergy R, HyPix diffractometer, Cu Kalpha radiation; main text says 150 K and CIF reports about 100 K

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2023 · Structures and electrical conductivities of a series of coordination polymers based on tetrathiafulvalene

Complex 3 single crystals · Single Crystal · Micro-focus metal-jet diffractometer, Ga Kalpha radiation; CIF reports 100 K

Diffraction StructurePowder

Powder XRD

2023 · Sulfur-Bridged Bonds Heightened Na-Storage Properties in MnS Nanocubes Encapsulated by S-Doped Carbon Matrix Synthesized via Solvent-Free Tactics for High-Performance Hybrid Sodium Ion Capacitors

MSC-850 C-sublimed sulfur / MSC · Powder · MC and MSC before/after sulfuration; optimisation series for carbonisation/sulfuration temperature and sulfur source in SI.

OtherUnspecified subtype

Thermogravimetric analysis and residual XRD

2023 · Sulfur-Bridged Bonds Heightened Na-Storage Properties in MnS Nanocubes Encapsulated by S-Doped Carbon Matrix Synthesized via Solvent-Free Tactics for High-Performance Hybrid Sodium Ion Capacitors

MSC-850 C-sublimed sulfur / MSC · Powder · TGA/DSC from 50 to 700 C under air at 10 C min-1; residual phase identified as Mn2O3.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2023 · Sulfur-Bridged Bonds Heightened Na-Storage Properties in MnS Nanocubes Encapsulated by S-Doped Carbon Matrix Synthesized via Solvent-Free Tactics for High-Performance Hybrid Sodium Ion Capacitors

Zn/Mn-MOFs · Powder · Zn/MnCO3 precursor and Zn/Mn-MOFs; Cu K-alpha source per SI methods.

Diffraction StructurePowderRefinement

Le Bail refinement of PXRD

2023 · Super Proton Conductivity Through Control of Hydrogen-Bonding Networks in Flexible Metal–Organic Frameworks

Im@MIL-88B-LB · Powder · Cell parameters and space groups for dried/as-synthesised MIL-88B and imidazole-loaded SB/LB states.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2023 · Super Proton Conductivity Through Control of Hydrogen-Bonding Networks in Flexible Metal–Organic Frameworks

MIL-88B · Powder · Cu Kalpha1 radiation, 2 theta 5-40 deg, 0.01 deg step, 5 deg/min; used for phase and breathing assignments.

Diffraction StructurePowderSingle crystal

single-crystal X-ray diffraction and powder X-ray diffraction

2023 · Synthesis, structure, and lithium storage performance of non-conductive metal–organic frameworks for high-performance lithium-ion batteries

Ni-mba-Na black fibrous product · Powder · SXRD on Bruker Smart-1000 CCD; PXRD on Bruker D8 ADVANCE with Cu Kalpha, 40 kV, 40 mA, step size 0.01 deg, scan speed 0.1 s step-1

Diffraction StructureUnspecified subtype

Simulated X-ray diffraction pattern in SI

2023 · The rise of 2D conductive metal-organic framework: Cu3(HHTP)2 d-π MOF for integrated battery-supercapacitor hybrids

As-synthesised Cu3(HHTP)2 dark-blue crystalline solid · Powder · Supplementary simulated XRD pattern used as structural comparison for the experimental Cu3(HHTP)2 PXRD.

Diffraction StructurePowder

PXRD

2023 · Toward High-Performance Metal–Organic-Framework-Based Quasi-Solid-State Electrolytes: Tunable Structures and Electrochemical Properties

HKUST-1 nanoparticles · Powder · Powder X-ray diffraction compared with simulated patterns.

Diffraction StructurePowder

PXRD

2023 · Toward High-Performance Metal–Organic-Framework-Based Quasi-Solid-State Electrolytes: Tunable Structures and Electrochemical Properties

MOF-5 nanoparticles · Powder · Powder X-ray diffraction compared with simulated patterns.

Diffraction StructurePowder

PXRD

2023 · Toward High-Performance Metal–Organic-Framework-Based Quasi-Solid-State Electrolytes: Tunable Structures and Electrochemical Properties

Zn-MOF-74 activated nanoparticles · Powder · Powder X-ray diffraction compared with simulated patterns.

Diffraction StructurePowder

VT-PXRD and solution-treated PXRD

2023 · Two Dual-Function Zr/Hf-MOFs as High-Performance Proton Conductors and Amines Impedance Sensors

DUT-67(Hf) microcrystalline powder · Powder · thermal stability plus water/acid/base treatment; pH 1.5-12.5

Diffraction StructurePowder

VT-PXRD and solution-treated PXRD

2023 · Two Dual-Function Zr/Hf-MOFs as High-Performance Proton Conductors and Amines Impedance Sensors

DUT-67(Zr) microcrystalline powder · Powder · thermal stability plus water/acid/base treatment; pH 1.5-12.5

Diffraction StructurePowder

PXRD / structural assignment

2023 · Two Dual-Function Zr/Hf-MOFs as High-Performance Proton Conductors and Amines Impedance Sensors

DUT-67(Hf) microcrystalline powder · Powder · crystal structure and PXRD comparison; cubic Fm-3m, reo topology

Diffraction StructurePowder

PXRD / structural assignment

2023 · Two Dual-Function Zr/Hf-MOFs as High-Performance Proton Conductors and Amines Impedance Sensors

DUT-67(Zr) microcrystalline powder · Powder · crystal structure and PXRD comparison; cubic Fm-3m, reo topology

Diffraction StructurePowderGrazing incidence

Out-of-plane X-ray diffraction/GIXRD and powder XRD

2023 · Two-Dimensional Conductive Metal-Organic Framework Reinforced Spinterface in Organic Spin Valves

PcM-Cu-nC MOF film series (M = Ni, Cu, H2; n = 10-40 cycles) · Thin Film · PcM-Cu-30C films on glass and PcM-Cu powders.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement; simulated AA/AB stacking models

2023 · Two-Dimensional Conjugated Metal-Organic Frameworks with Large Pore Apertures and High Surface Areas for NO2 Selective Chemiresistive Sensing

HIOTP-Ni black powder · Powder · Powder X-ray diffraction; Materials Studio/Reflex simulations compared with experimental patterns.

Diffraction StructurePowder

powder X-ray diffraction with Cu-K(alpha) radiation

2023 · Ultrasensitive levofloxacin electrochemical biosensor based on semiconducting covalent organic framework/poly-L-cysteine/triangular Ag nanoplates modified glassy carbon electrode

TABQ-CHHO-COF powder · Powder · PXRD pattern used to assess crystallinity of TABQ-CHHO-COF.

Diffraction StructurePowderRefinement

PXRD with Pawley fitting

2023 · Wavy Two-Dimensional Conjugated Metal-Organic Framework with Metallic Charge Transport

Cu3(HFcHBC)2 polycrystalline film · Thin Film · Collected film samples; Cu-Kalpha radiation; room temperature/reflection geometry.

Diffraction StructurePowder

Powder X-ray diffraction and thermogravimetric analysis

2022 · 2D Cd(II)-MOF of Pyridyl-Imidazoquinazoline: Structure, Luminescence, and Selective Detection of TNP and Fabrication of Semiconducting Devices

as-synthesised crystalline powder CP 1 · Powder · PXRD at room temperature using Cu Kalpha radiation, 2theta 5-50 degrees; TGA under N2 from 30-800 C at 10 C min^-1.

Diffraction StructureGrazing incidence

GIXRD / XRD with Williamson-Hall fitting

2022 · 2D Metal–Organic Framework Cu3(HHTT)2 Films for Broadband Photodetectors from Ultraviolet to Mid-Infrared

Optimised 12-cycle Cu3(HHTT)2 film on SiO2/Si · Thin Film · Out-of-plane and in-plane GIXRD on 132 nm optimised film prepared from 1 mM Cu(OAc)2 / 0.1 mM HHTT ethanol on SiO2/Si.

Diffraction StructureUnspecified subtype

X-ray diffraction

2022 · 3D Co-doped Ni-based conductive MOFs modified electrochemical sensor for highly sensitive detection of L-tryptophan

Co-Ni-MOFs doped-ratio powder series · Powder · XRD spectra of Co-Ni-MOFs and Ni-MOFs from 5-40 degrees 2theta.

Electrochemistry ApplicationUnspecified subtype

Post-ORR SEM, XRD and XPS

2022 · A 2D copper-imidazolate framework without thermal treatment as an efficient ORR electrocatalyst for Zn-air batteries

2DCIF-modified ITO electrode before/after ORR · Electrode · 2DCIF-modified ITO examined before and after ORR electrochemical analysis

Diffraction StructurePowder

powder X-ray diffraction pattern matching

2022 · A Mixed Heterobimetallic Y/Eu-MOF for the Cyanosilylation and Hydroboration of Carbonyls

Y/Eu-MOF crystalline catalyst · Single Crystal · Philips X'PERT powder diffractometer, Cu K alpha radiation, 5 < 2 theta < 50 deg, 0.02 deg step, 2.5 s per step at 25 C; FULLPROF indexation.

Diffraction StructurePowder

PXRD and FT-IR

2022 · A Mixed Heterobimetallic Y/Eu-MOF for the Cyanosilylation and Hydroboration of Carbonyls

Y/Eu-MOF crystalline catalyst · Single Crystal · Phase and ligand/framework confirmation; detailed plots are in missing SI Figures S1 and S2.

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction and structure refinement

2022 · A Mixed Heterobimetallic Y/Eu-MOF for the Cyanosilylation and Hydroboration of Carbonyls

Y/Eu-MOF crystalline catalyst · Single Crystal · Data collected at 100(2) K with Mo K alpha radiation; solved with SHELXT and refined with SHELXL-2018/3.

Diffraction StructureUnspecified subtype

in situ XRD during first cycle

2022 · A Monocrystalline Coordination Polymer with Multiple Redox Centers as a High-Performance Cathode for Lithium-Ion Batteries

CuCA composite electrode in liquid-electrolyte LIB coin cell · Electrode · CuCA electrode cast on Be slice; Li metal anode; GFD separator; 1.0 M LiTFSI in DME/DOL; current density 100 mA g-1.

Diffraction StructurePowderRefinement

powder X-ray diffraction with Rietveld refinement

2022 · A Monocrystalline Coordination Polymer with Multiple Redox Centers as a High-Performance Cathode for Lithium-Ion Batteries

as-synthesised CuCA nanosheet powder · Nanosheet · Cu K alpha radiation; refined monoclinic CuCA structure; comparison with calculated pattern.

Diffraction StructureGrazing incidence

GIWAXS/GISAXS and XRD

2022 · A Novel Electrically Conductive Perylene Diimide-Based MOF-74 Series Featuring Luminescence and Redox Activity

PDI-MOF-74(Zn) VAC film on glass · Thin Film · PDI-MOF-74(Zn) film grown on glass by VAC; diffraction confirms crystalline film with random crystallite distribution

Diffraction StructurePowderRefinement

powder X-ray diffraction; Pawley refinement

2022 · A Novel Electrically Conductive Perylene Diimide-Based MOF-74 Series Featuring Luminescence and Redox Activity

PDI-MOF-74(Mg) powder · Powder · Bruker D8, Cu Kalpha; simulated MOF-74 model refined to experimental PXRD; best refinements in triclinic P1

Diffraction StructurePowderRefinement

powder X-ray diffraction; Pawley refinement

2022 · A Novel Electrically Conductive Perylene Diimide-Based MOF-74 Series Featuring Luminescence and Redox Activity

PDI-MOF-74(Ni) powder · Powder · Bruker D8, Cu Kalpha; simulated MOF-74 model refined to experimental PXRD; best refinements in triclinic P1

Diffraction StructurePowderRefinement

powder X-ray diffraction; Pawley refinement

2022 · A Novel Electrically Conductive Perylene Diimide-Based MOF-74 Series Featuring Luminescence and Redox Activity

PDI-MOF-74(Zn) powder · Powder · Bruker D8, Cu Kalpha; simulated MOF-74 model refined to experimental PXRD; best refinements in triclinic P1

Microscopy MorphologyGrazing incidence

SEM, AFM/HRAFM, TEM and GIWAXS

2022 · A one-dimensional conductive metal-organic framework with extended π-d conjugated nanoribbon layers

DDA-Cu MOF film · Thin Film · films grown 12-72 h; 25 nm film for GIWAXS

Diffraction StructurePowderRefinement

PXRD and Pawley refinement

2022 · A one-dimensional conductive metal-organic framework with extended π-d conjugated nanoribbon layers

DDA-Cu MOF crystals / bulk precipitate · Powder · bulk crystalline DDA-Cu compared with theoretical pattern

OtherPowder

TGA and post-soak PXRD

2022 · A one-dimensional conductive metal-organic framework with extended π-d conjugated nanoribbon layers

DDA-Cu MOF crystals / bulk precipitate · Powder · TGA in N2; chemical soaking 24 h

Diffraction StructureUnspecified subtype

Ex-situ XRD, SEM, and dissolution observation of cycled electrodes

2022 · A Rationally Designed Iron–Dihydroxybenzoquinone Metal–Organic Framework as Practical Cathode Material for Rechargeable Batteries

Fe2(DHBQ)3 electrode A/default (AM/KB/PTFE = 6:3:1, low loading) · Electrode · XRD of pristine/discharged/recharged and charged-state electrodes over cycles; SEM Fig. S21; dissolution in 1 mL 1 M LiTFSI/DOL-DME for 96 h.

Diffraction StructureUnspecified subtype

Literature crystallographic comparison and simulated XRD reference

2022 · A Rationally Designed Iron–Dihydroxybenzoquinone Metal–Organic Framework as Practical Cathode Material for Rechargeable Batteries

(NBu4)2Fe2(DHBQ)3 literature reference structure · Unknown · CCDC No. 839253 lattice structure and simulated pattern compared with experimental Fe2(DHBQ)3 powder XRD.

Diffraction StructurePowderRefinement

Powder XRD with Le Bail refinement

2022 · A Rationally Designed Iron–Dihydroxybenzoquinone Metal–Organic Framework as Practical Cathode Material for Rechargeable Batteries

air-stabilised Fe2(DHBQ)3 powder · Powder · MiniFlex 600, Cu Kalpha1 radiation; no single crystal obtained.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2022 · A stable lanthanum hydroxamate metal-organic framework with radical character and electrical conductivity

Gd-ONDI microcrystalline material · Powder · PXRD patterns and unit-cell refinement for Sm-ONDI, Gd-ONDI and Dy-ONDI; Gd-ONDI is used as representative sample key and Dy-ONDI values are also recorded in results.

Diffraction StructureUnspecified subtype

XRD, FT-IR and SEM after GA/DNA modification

2022 · Adjustable Synthesis of Ni-Based Metal-Organic Framework Membranes and Their Field-Effect Transistor Sensors for Mercury Detection

S4-based Ni3(HITP)2-GA-DNA FET sensor · Electrode · Structural and morphology checks of the S4-based Ni3(HITP)2-GA-DNA sensor after GA and DNA probe modification.

Diffraction StructurePowder

PXRD and FT-IR

2022 · Adjustable Synthesis of Ni-Based Metal-Organic Framework Membranes and Their Field-Effect Transistor Sensors for Mercury Detection

S4 Ni3(HITP)2 membrane · Thin Film · PXRD and FT-IR analysis of S1-S4 samples; result row captures common phase/peak assignment for the Ni3(HITP)2 membrane series.

Electrochemistry ApplicationUnspecified subtype

XRD, Raman and Li 1s XPS after discharge/charge

2022 · Atomic Ruthenium-Riveted Metal-Organic Framework with Tunable d-Band Modulates Oxygen Redox for Lithium-Oxygen Batteries

NiRu-HTP nanowire-array electrode on carbon paper · Electrode · discharged/charged cathode product identification

Diffraction StructurePowderRefinement

powder XRD with Pawley/Rietveld refinement

2022 · Atomic Ruthenium-Riveted Metal-Organic Framework with Tunable d-Band Modulates Oxygen Redox for Lithium-Oxygen Batteries

Ni-HTP powder · Powder · Cu Kalpha radiation, Rigaku MiniFlex600; crystalline structure assignment

Diffraction StructurePowderRefinement

powder XRD with Pawley/Rietveld refinement

2022 · Atomic Ruthenium-Riveted Metal-Organic Framework with Tunable d-Band Modulates Oxygen Redox for Lithium-Oxygen Batteries

NiRu-HTP powder · Powder · Cu Kalpha radiation, Rigaku MiniFlex600; crystalline structure assignment

Diffraction StructurePowder

Post-electrolysis PXRD, FT-IR, XPS and recycling electrolysis

2022 · Atomically Precise Integration of Multiple Functional Motifs in Catalytic Metal-Organic Frameworks for Highly Efficient Nitrate Electroreduction

In8 catalyst ink on carbon paper electrode · Electrode · In8 before/after electrolysis for three cycles and after 12 cycles h-1 in pH 2-5 H2SO4/KNO3 electrolytes.

Diffraction StructureUnspecified subtype

Post-electrochemical HR-TEM and XRD

2022 · Bifunctional 3D-MOF-based nanoprobes for electrochemical sensing and nanozyme enhanced with peroxidase mimicking for colorimetric detection of acetaminophen

ZIF-67-C/GCE modified electrode · Electrode · ZIF-67-C after electrochemical ACM sensing; SI Fig. S1(A-B) HR-TEM and Fig. S1(C) XRD.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Bifunctional 3D-MOF-based nanoprobes for electrochemical sensing and nanozyme enhanced with peroxidase mimicking for colorimetric detection of acetaminophen

ZIF-67-C powder · Powder · PXRD of ZIF-67-C, ZIF-67-A, and ZIF-67-H; post-electrocatalysis XRD mentioned in SI Fig. S1(C), but the supplied SI text contains only the caption.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Boosting the Optoelectronic Performance by Regulating Exciton Behaviors in a Porous Semiconductive Metal-Organic Framework

RhB+@TbTATAB guest-loaded crystals · Powder · PXRD 3-50 deg with Cu Kalpha radiation, Bruker D8 Advance; used to compare experimental TbTATAB, RhB+@TbTATAB, simulated TbTATAB and computational RhB+@TbTATAB.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2022 · Boosting the Optoelectronic Performance by Regulating Exciton Behaviors in a Porous Semiconductive Metal-Organic Framework

as-synthesised TbTATAB powder/crystals · Powder · Structure assignment of TbTATAB framework.

Diffraction StructurePowder

Powder XRD

2022 · Boron-doped cobalt-iron bimetal phosphides nanosheets for enhanced oxygen evolution

Co1Fe1-B-P · Nanosheet · XRD phase identification after boronation and phosphidation.

Diffraction StructurePowder

Powder XRD

2022 · Boron-doped cobalt-iron bimetal phosphides nanosheets for enhanced oxygen evolution

Co1Fe1-MOF · Powder · Bruker D8 Advance with Cu-Kalpha radiation; scan rate 5 deg/min.

Diffraction StructurePowderRefinement

PXRD with Le Bail refinement using Rietica

2022 · Bromine Vapor Induced Continuous p- to n-Type Conversion of a Semiconductive Metal-Organic Framework Cu[Cu(pdt)2]

Brx@Cu[Cu(pdt)2] bromine-doped series · Powder · Rigaku Smart Lab, Cu Kalpha radiation, lambda = 1.5456 A, 2theta 5-50 deg, 1 deg/min.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Bromo- and iodo-bridged building units in metal-organic frameworks for enhanced carrier transport and CO2 photoreduction by water vapor

As-synthesised TMOF-10-NH2(I) · Single Crystal · PXRD patterns recorded from 5-40 degrees 2theta and compared with simulations from single-crystal data.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2022 · Bromo- and iodo-bridged building units in metal-organic frameworks for enhanced carrier transport and CO2 photoreduction by water vapor

[Pb(NH2-bdc)]n control · Single Crystal · Mo Kalpha radiation at 296(2) K.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2022 · Bromo- and iodo-bridged building units in metal-organic frameworks for enhanced carrier transport and CO2 photoreduction by water vapor

As-synthesised TMOF-10-NH2(Br) · Single Crystal · Mo Kalpha radiation, ambient temperature, Bruker SMART APEX II CCD; structure refined by SHELXTL/APEX3 and DIAMOND.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2022 · Bromo- and iodo-bridged building units in metal-organic frameworks for enhanced carrier transport and CO2 photoreduction by water vapor

As-synthesised TMOF-10-NH2(I) · Single Crystal · Mo Kalpha radiation, ambient temperature, Bruker SMART APEX II CCD; structure refined by SHELXTL/APEX3 and DIAMOND.

Diffraction StructureUnspecified subtype

Out-of-plane X-ray diffraction (XRD)

2022 · Chemical sensors based on ionically conductive metal-organic frameworks for selective cadaverine detection

IC-CuTHPP thin-film sensor on ITO interdigital electrode · Electrode · CuTHPP IC-MOF thin films before and after cadaverine detection.

Diffraction StructurePowderRefinement

Synchrotron PXRD, Rietveld refinement and CIF/checkCIF analysis

2022 · Chemical structure modulation in conductive MOFs by adjusting the oxidation state of the ligand and introducing alkali metal ions

MnCsTHBQ powder · Powder · Debye-Scherrer transmission configuration; BL14B1 Shanghai Synchrotron Radiation Facility; wavelength about 0.69003 A.

Diffraction StructurePowderRefinement

Synchrotron PXRD, Rietveld refinement and CIF/checkCIF analysis

2022 · Chemical structure modulation in conductive MOFs by adjusting the oxidation state of the ligand and introducing alkali metal ions

MnHHB dark-blue powder · Powder · Debye-Scherrer transmission configuration; BL14B1 Shanghai Synchrotron Radiation Facility; wavelength about 0.69003 A.

Diffraction StructurePowderRefinement

Synchrotron PXRD, Rietveld refinement and CIF/checkCIF analysis

2022 · Chemical structure modulation in conductive MOFs by adjusting the oxidation state of the ligand and introducing alkali metal ions

MnRbTHBQ powder · Powder · Debye-Scherrer transmission configuration; BL14B1 Shanghai Synchrotron Radiation Facility; wavelength about 0.69003 A.

Diffraction StructureUnspecified subtype

Control CVD product inspection and XRD/photograph

2022 · Chemical Vapor Deposition of Edge-on Oriented 2D Conductive Metal-Organic Framework Thin Films

Conventional CVD control film without face-to-face inner tubes · Thin Film · Conventional CVD without face-to-face inner tube system.

Diffraction StructureGrazing incidenceRefinement

Synchrotron GIWAXS and XRD with Pawley refinement

2022 · Chemical Vapor Deposition of Edge-on Oriented 2D Conductive Metal-Organic Framework Thin Films

CVD Cu3(C6O6)2 thin film on SiO2/Si · Thin Film · GIWAXS patterns integrated and Pawley fitted using slipped-parallel Cu3(C6O6)2 structural model; data converted to Cu K alpha.

Diffraction StructureUnspecified subtype

XRD Scherrer analysis

2022 · Coarsening-induced hierarchically interconnected porous carbon polyhedrons for stretchable ionogel-based supercapacitors

Cu@C_12 h · Powder · Metallic Cu crystallite size in Cu@C_12h.

Diffraction StructureUnspecified subtype

XRD Scherrer analysis

2022 · Coarsening-induced hierarchically interconnected porous carbon polyhedrons for stretchable ionogel-based supercapacitors

Cu@C_1 h · Powder · Metallic Cu crystallite size in Cu@C_1h.

Diffraction StructureUnspecified subtype

XRD, nitrogen sorption and TGA

2022 · Coarsening-induced hierarchically interconnected porous carbon polyhedrons for stretchable ionogel-based supercapacitors

polymer@MOF · Powder · Structure retention and residual metal comparison for mMOF/polymer@MOF.

SpectroscopyUnspecified subtype

ex situ XPS, FTIR, and XRD for lithiation/delithiation

2022 · Conductive Co-based metal organic framework nanostructures for excellent potassium- and lithium-ion storage: kinetics and mechanism studies

Co-CAT MOF LIB anode electrode · Electrode · Fresh, lithiated, and delithiated Co-CAT MOF electrodes analysed for C 1s, Co 2p, FTIR, and XRD changes.

Diffraction StructurePowder

powder X-ray diffraction (Rigaku Smart Lab)

2022 · Conductive Co-based metal organic framework nanostructures for excellent potassium- and lithium-ion storage: kinetics and mechanism studies

as-synthesised Co-CAT MOF powder · Powder · Measured XRD pattern compared with calculated Co-CAT crystals.

PorosityGrazing incidenceWide / small angle scattering

Grazing-incidence small-angle X-ray scattering (GI-SAXS)

2022 · Conductive Hybrid Cu-HHTP-TCNQ Metal–Organic Frameworks for Chemiresistive Sensing

Cu-HHTP-TCNQ film on silicon wafer for GI-SAXS, 40 min · Thin Film · Nanostar X-ray scattering system, CuKalpha lambda = 0.154 nm, incident grazing angles 0.15-0.3 deg, experiments in vacuum about 0.01 mbar.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2022 · Conductive Hybrid Cu-HHTP-TCNQ Metal–Organic Frameworks for Chemiresistive Sensing

Merged Cu-HHTP-TCNQ film powder for XRD · Powder · PANALYTICAL X'pert Powder, CuKalpha source lambda = 1.5406 A, reflection mode, 60 h; background subtraction from sample-holder measurement.

Diffraction StructureUnspecified subtype

Transmission XRD before/after washing and drying

2022 · Conductive Hybrid Cu-HHTP-TCNQ Metal–Organic Frameworks for Chemiresistive Sensing

Merged Cu-HHTP-TCNQ film powder for XRD · Powder · Thin films synthesized by standard interfacial procedure at 0 C for 45 min, collected by loop holder, measured directly after synthesis and after washing/drying on STOE IPDS II with MoKalpha source.

Diffraction StructurePowder

SEM, TEM, EDS mapping, and powder XRD

2022 · Conductive metal organic framework for ion-selective membrane-free solid-contact potentiometric Cu2+ sensing

As-synthesised Cu3(HHTP)2 black powder · Powder · SEM/TEM/EDS used to assess morphology and elemental distribution; XRD compared with prior Cu3(HHTP)2 patterns.

Diffraction StructurePowder

Powder X-ray diffraction (Bruker D8 Advance, Cu-Kalpha)

2022 · Conductive Metal-Organic Frameworks Bearing M−O4 Active Sites as Highly Active Biomass Valorization Electrocatalysts

Co-CAT powder · Powder · XRD patterns for Co-CAT and Ni-CAT powders and carbon-paper samples; compared with calculated Co-CAT pattern over 2theta = 5-20 degrees.

Diffraction StructurePowder

PXRD and FT-IR

2022 · Conductive NiCo bimetal-organic framework nanorods with conductivity-enhanced electrochemiluminescence for constructing biosensing platform

NiCo-HHTP nanorods · Powder · PXRD patterns of NiCo-HHTP and Ni-HHTP and simulated Ni-HHTP; FT-IR spectra of both MOFs.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Conductive NiCo bimetal-organic framework nanorods with conductivity-enhanced electrochemiluminescence for constructing biosensing platform

NiCo-HHTP nanorods · Powder · PXRD pattern of NiCo-HHTP compared with experimental and simulated Ni-HHTP patterns.

Diffraction StructurePowderRefinement

PXRD Pawley refinement

2022 · Conjugated Metal-Organic Macrocycles: Synthesis, Characterization, and Electrical Conductivity

CuTOTP-OC18 bulk powder/pellet sample · Powder · High-resolution PXRD of dried and DMF-solvated CuTOTP-OR sealed in Kapton capillaries; Pawley refinement of lattice parameters.

Diffraction StructurePowderRefinement

PXRD Pawley refinement

2022 · Conjugated Metal-Organic Macrocycles: Synthesis, Characterization, and Electrical Conductivity

CuTOTP-OC2 bulk powder/pellet sample · Powder · High-resolution PXRD of dried and DMF-solvated CuTOTP-OR sealed in Kapton capillaries; Pawley refinement of lattice parameters.

Diffraction StructurePowderRefinement

PXRD Pawley refinement

2022 · Conjugated Metal-Organic Macrocycles: Synthesis, Characterization, and Electrical Conductivity

CuTOTP-OC4 bulk powder/pellet sample · Powder · High-resolution PXRD of dried and DMF-solvated CuTOTP-OR sealed in Kapton capillaries; Pawley refinement of lattice parameters.

Diffraction StructurePowderRefinement

PXRD Pawley refinement

2022 · Conjugated Metal-Organic Macrocycles: Synthesis, Characterization, and Electrical Conductivity

CuTOTP-OC6 bulk powder/pellet sample · Powder · High-resolution PXRD of dried and DMF-solvated CuTOTP-OR sealed in Kapton capillaries; Pawley refinement of lattice parameters.

SpectroscopyPowder

FTIR and powder X-ray diffraction

2022 · Constructing a Redox-Active Cu(I)-Pyridyltriazine Framework for Catalytic Photoreduction of Nitrobenzenes and Carboxylic Cyclization of Alkynol with CO2

As-synthesised Cu(I)-TPT orange rhombus single crystals · Single Crystal · FTIR of TPT and Cu(I)-TPT; PXRD comparison of experimental and simulated patterns.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Bruker APEX-II CCD, Mo Kalpha radiation

2022 · Constructing a Redox-Active Cu(I)-Pyridyltriazine Framework for Catalytic Photoreduction of Nitrobenzenes and Carboxylic Cyclization of Alkynol with CO2

As-synthesised Cu(I)-TPT orange rhombus single crystals · Single Crystal · Single crystal sealed in a glass tube; data collected at 150 K; solved with Olex2 and refined by Gauss-Newton minimisation.

Diffraction StructurePowder

PXRD and thermogravimetric analysis

2022 · Crystal Structure and Electrochemical and Charge Transfer Properties in Redox-Active Coordination Polymers Based on a Truncated Tetrathiafulvalene Linker

as-synthesised Cd-m-TTFTB red rod-like crystals · Powder · PXRD at room temperature; TGA at 10 C/min under N2.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Crystal Structure and Electrochemical and Charge Transfer Properties in Redox-Active Coordination Polymers Based on a Truncated Tetrathiafulvalene Linker

as-synthesised Cd-m-TTFTB red rod-like crystals · Powder · SCXRD at 296 K using Mo K alpha radiation on a Bruker D8 Venture diffractometer.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Crystal Structure and Electrochemical and Charge Transfer Properties in Redox-Active Coordination Polymers Based on a Truncated Tetrathiafulvalene Linker

m-H4TTFTB ligand control · Powder · Molecular linker single-crystal structure at 192.98 K.

Diffraction StructurePowder

PXRD and thermogravimetric analysis

2022 · Crystal Structure and Electrochemical and Charge Transfer Properties in Redox-Active Coordination Polymers Based on a Truncated Tetrathiafulvalene Linker

as-synthesised Zn-m-TTFTB red rod-like crystals · Powder · PXRD at room temperature; TGA at 10 C/min under N2.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Crystal Structure and Electrochemical and Charge Transfer Properties in Redox-Active Coordination Polymers Based on a Truncated Tetrathiafulvalene Linker

as-synthesised Zn-m-TTFTB red rod-like crystals · Powder · SCXRD at 100 K; data collected at Shanghai Synchrotron Radiation Facility.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Defect Engineering to Tailor Metal Vacancies in 2D Conductive Metal-Organic Frameworks: An Example in Electrochemical Sensing

Cu-BHT film prepared at pH 2 · Thin Film · XRD patterns collected for Cu-BHT films prepared at pH 0, 1, and 2.

Diffraction StructurePowderRefinement

High-resolution synchrotron PXRD Rietveld refinement

2022 · Dimensionality Modulates Electrical Conductivity in Compositionally Constant One-, Two-, and Three-Dimensional Frameworks

Ni-1D rods/bricks · Powder · APS 11-BM synchrotron PXRD at 100 K and 295 K; TOPAS Academic refinement.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Dissecting π-conjugated covalent-coupling over conductive MOFs toward efficient two-electron oxygen reduction

Cu-HHTP nanorod powder · Powder · 2theta range 3-40 deg; Philips X'Pert Pro Super diffractometer; compared with Ni-HITP and Cu-HITP.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Dissecting π-conjugated covalent-coupling over conductive MOFs toward efficient two-electron oxygen reduction

Cu-HITP powder · Powder · 2theta range 3-40 deg; Philips X'Pert Pro Super diffractometer; compared with Ni-HITP and Cu-HHTP.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Dissecting π-conjugated covalent-coupling over conductive MOFs toward efficient two-electron oxygen reduction

Ni-HITP black powder · Powder · 2theta range 3-40 deg; Philips X'Pert Pro Super diffractometer; compared with Cu-HITP and Cu-HHTP.

Diffraction StructurePowder

PXRD in reflection mode, CuKalpha1 radiation

2022 · Does the Mode of Metal-Organic Framework/Electrode Adhesion Determine Rates for Redox-Hopping-Based Charge Transport within Thin-Film Metal-Organic Frameworks?

EPD-MOF-525 · Thin Film · Compared with simulated MOF-525 and powder patterns; low-angle check for PCN-222 in SI

Diffraction StructurePowder

PXRD in reflection mode, CuKalpha1 radiation

2022 · Does the Mode of Metal-Organic Framework/Electrode Adhesion Determine Rates for Redox-Hopping-Based Charge Transport within Thin-Film Metal-Organic Frameworks?

ST-MOF-525 · Thin Film · Compared with simulated MOF-525 and powder patterns; film collected with/without spinning

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Dual nanozyme based on ultrathin 2D conductive MOF nanosheets intergraded with gold nanoparticles for electrochemical biosensing of H2O2 in cancer cells

Cu-HHTP-NSs · Nanosheet · PXRD comparison of Cu-HHTP-bulk, Cu-HHTP-NSs and Au-NPs/Cu-HHTP-NSs.

Diffraction StructurePowder

PXRD after acid/base water stability exposure

2022 · Efficient sequestration of radioactive 99TcO4- by a rare 3-fold interlocking cationic metal-organic framework: A combined batch experiments, pair distribution function, and crystallographic investigation

ZJU-X6 powder/material for batch sorption · Powder · ZJU-X6 exposed to HNO3/NaOH solutions from pH 3 to 11, stirred 12 h/overnight, washed with deionized water, filtered and dried; PXRD used to confirm stability.

Diffraction StructureTotal scattering / PDF

X-ray pair distribution function (PDF)

2022 · Efficient sequestration of radioactive 99TcO4- by a rare 3-fold interlocking cationic metal-organic framework: A combined batch experiments, pair distribution function, and crystallographic investigation

ZJU-X6-Re / ReO4-loaded ZJU-X6 · Single Crystal · Bruker D8 Discover diffractometer; 2D Eiger2R_500K detector at 280 mm; 1 mm borosilicate capillaries; Ag source lambda = 0.560871 A; Si powder calibration; processed with PDFgetX3.

SpectroscopyPowder

TEM-EDS mapping, FT-IR, TGA and PXRD after ReO4- sorption

2022 · Efficient sequestration of radioactive 99TcO4- by a rare 3-fold interlocking cationic metal-organic framework: A combined batch experiments, pair distribution function, and crystallographic investigation

ZJU-X6-Re / ReO4-loaded ZJU-X6 · Single Crystal · ReO4-loaded ZJU-X6 characterised by TEM-EDS mapping, FT-IR, thermogravimetric analysis, and PXRD.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2022 · Efficient sequestration of radioactive 99TcO4- by a rare 3-fold interlocking cationic metal-organic framework: A combined batch experiments, pair distribution function, and crystallographic investigation

ZJU-X6 yellow crystals · Single Crystal · Bruker D8-Venture diffractometer; Mo-Kalpha lambda = 0.71073 A and Ga-Kalpha lambda = 1.34139 A; CMOS detector; data collected at 100 K, 173 K and 296 K; SAINT/APEX3 and SHELXTL-2014 refinement.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction of ReO4-loaded ZJU-X6

2022 · Efficient sequestration of radioactive 99TcO4- by a rare 3-fold interlocking cationic metal-organic framework: A combined batch experiments, pair distribution function, and crystallographic investigation

ZJU-X6-Re / ReO4-loaded ZJU-X6 · Single Crystal · ZJU-X6-Re single crystals analysed by single-crystal X-ray diffraction; crystallographic data and refinement details are listed in SI Table S1.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction of 99TcO4-incorporated ZJU-X6

2022 · Efficient sequestration of radioactive 99TcO4- by a rare 3-fold interlocking cationic metal-organic framework: A combined batch experiments, pair distribution function, and crystallographic investigation

ZJU-X6-Tc / 99TcO4-loaded ZJU-X6 · Single Crystal · ZJU-X6-Tc single crystals obtained after immersion in 99TcO4- solution; single-crystal structure used to identify TcO4- binding mode and hydrogen bonding.

Diffraction StructurePowder

PXRD comparison of activation states

2022 · Electrical conductivity through π–π stacking in a two-dimensional porous gallium catecholate metal–organic framework

Ga9(HOTP)4 powder activated by heating in vacuo · Powder · PXRD patterns compared for supercritical CO2-activated, heating-in-vacuo activated, and as-made Ga9(HOTP)4.

Diffraction StructurePowderRefinement

Powder X-ray diffraction Rietveld refinement in TOPAS Academic V6

2022 · Electrical conductivity through π–π stacking in a two-dimensional porous gallium catecholate metal–organic framework

As-made Ga9(HOTP)4 microcrystalline powder · Powder · Capillary PXRD in Debye-Scherrer geometry on dry material mixed with 5-10 wt.% alpha-Al2O3 internal standard; Bruker D8 Advance, Cu Kalpha1,2, 295 K.

Diffraction StructurePowder

powder X-ray diffraction

2022 · Electrically Conductive Photoluminescent Porphyrin Phosphonate Metal–Organic Frameworks

GTUB3 single crystals / crystal powder · Single Crystal · RIGAKU 2200 DMAX with CuKalpha radiation, lambda = 0.154 nm, 40 kV and 40 mA; 2theta scan 5-50 deg; compared with simulated pattern from Mercury.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Electrically Conductive Photoluminescent Porphyrin Phosphonate Metal–Organic Frameworks

GTUB3 single crystals / crystal powder · Single Crystal · Bruker APEX II QUAZAR; MoKalpha radiation, lambda = 0.71073 A; data collected at 296 K; solved with SHELXT and refined with SHELXL/Olex2; SQUEEZE applied.

Diffraction StructureUnspecified subtype

Out-of-plane and in-plane XRD

2022 · Electrically regulating nonlinear optical limiting of metal-organic framework film

Cu-HHTP[001] film · Thin Film · MiniFlex2 X-ray diffractometer, Cu Kalpha radiation, 2theta range 3-30 deg, scan rate 0.5 deg min-1; compared to simulated pattern and powder.

Diffraction StructurePowder

Powder XRD

2022 · Electrocatalytic oxygen evolution reaction at IrOx supported by Ni/Co-ZIF-67: Controlled ratio of metallic Ir and Ir3+ states

2.8-IrOx@Ni/Co-ZIF-67 / IrOx@Ni/Co-ZIF-67 · Nanosheet · XRD of Ni/Co-ZIF-67 and IrOx@Ni/Co-ZIF-67 with different IrOx contents.

Diffraction StructurePowder

Powder XRD

2022 · Electrocatalytic oxygen evolution reaction at IrOx supported by Ni/Co-ZIF-67: Controlled ratio of metallic Ir and Ir3+ states

Ni/Co-ZIF-67-2 / Ni/Co-ZIF-67 · Nanosheet · Same powder XRD method; comparison with standard ZIF-67 and pristine ZIF-67.

Diffraction StructurePowder

Powder XRD

2022 · Electrocatalytic oxygen evolution reaction at IrOx supported by Ni/Co-ZIF-67: Controlled ratio of metallic Ir and Ir3+ states

ZIF-67 nanosheet powder/control · Nanosheet · X'Pert PRO, Cu Kalpha radiation, 40 kV/30 mA, 2theta 10-80 deg, scan speed 0.02 deg s^-1.

Diffraction StructurePowder

PXRD after electrolyte soaking

2022 · Engineering the modulation of the active sites and pores of pristine metal-organic frameworks for high-performance sodium-ion storage

Ni-HHTP-250 · Powder · Ni-HHTP, Ni-HHTP-160, Ni-HHTP-250 and Ni-HHTP-340 soaked in NaCF3SO3/diglyme and NaClO4/(EC:DMC=1:1) electrolytes for 24 h, then measured by XRD.

Diffraction StructurePowder

PXRD and FT-IR

2022 · Engineering the modulation of the active sites and pores of pristine metal-organic frameworks for high-performance sodium-ion storage

Ni-HHTP-250 · Powder · PXRD with Cu K alpha radiation; FT-IR comparison of pristine and thermally treated samples.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Enhanced VOC adsorption capacity on MOF thin layer with reduced particle size by cryogrinding and microwave method

All MOF powder samples in paper · Powder · MOFs measured after activation by heating under vacuum to remove solvent.

Diffraction StructurePowderRefinement

PXRD/Rietveld refinement

2022 · Epitaxial Self-Assembly of Interfaces of 2D Metal-Organic Frameworks for Electroanalytical Detection of Neurotransmitters

Co3(HHTP)2 {001} oriented film on GCE · Electrode

Diffraction StructurePowderRefinement

PXRD/Rietveld refinement

2022 · Epitaxial Self-Assembly of Interfaces of 2D Metal-Organic Frameworks for Electroanalytical Detection of Neurotransmitters

Co3(HHTP)2 {100} nanorods on GCE · Electrode

Diffraction StructurePowderRefinement

PXRD/Rietveld refinement

2022 · Epitaxial Self-Assembly of Interfaces of 2D Metal-Organic Frameworks for Electroanalytical Detection of Neurotransmitters

Ni3(HHTP)2 {100} nanorods on GCE · Electrode

Diffraction StructurePowderRefinement

PXRD/Rietveld refinement

2022 · Epitaxial Self-Assembly of Interfaces of 2D Metal-Organic Frameworks for Electroanalytical Detection of Neurotransmitters

Ni3(HHTP)2 {001} oriented film on GCE · Electrode

Diffraction StructurePowder

powder X-ray diffraction (PXRD), Bruker D8 Discover, Cu K-alpha radiation

2022 · Exploration of Variable Temperature Magnetism and Electrical Properties of a Pyridyl-isonicotinoyl Hydrazone Bridged Three-Dimensional Mn-Metal-Organic Framework with a Thiophene Dicarboxylato Link

polycrystalline/finely ground compound 1 · Powder · finely ground sample at room temperature compared with simulated spectrum

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction (SCXRD), Bruker SMART APEX III, Mo K-alpha radiation, SHELX-97 refinement

2022 · Exploration of Variable Temperature Magnetism and Electrical Properties of a Pyridyl-isonicotinoyl Hydrazone Bridged Three-Dimensional Mn-Metal-Organic Framework with a Thiophene Dicarboxylato Link

yellow needle-shaped crystals of compound 1 · Single Crystal · single crystal 0.160 x 0.090 x 0.050 mm3; graphite-monochromated Mo K-alpha, lambda = 0.71073 Angstrom

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Fe–O–Zr in MOF for effective photo-Fenton Bisphenol A degradation: Boosting mechanism of electronic transmission

FeUiO-X series · Powder · Wide-angle XRD comparison of UiO-66 and FeUiO-X.

Diffraction StructureUnspecified subtype

X-ray diffraction (X'Pert Pro MPD)

2022 · Flexible Smart Wearable Co@C@Carbon Fabric for Efficient Electromagnetic Shielding, Thermal Therapy, and Human Movement Monitoring

Co-CCF-700/800/900/1000 · Thin Film · XRD patterns of Co-CCF-700/800/900/1000 and Co-PCCF-1000.

Diffraction StructureUnspecified subtype

X-ray diffraction (X'Pert Pro MPD)

2022 · Flexible Smart Wearable Co@C@Carbon Fabric for Efficient Electromagnetic Shielding, Thermal Therapy, and Human Movement Monitoring

ZIF-67@CF · Thin Film · XRD patterns used to identify crystalline ZIF-67 on cotton fabric.

Diffraction StructurePowder

Laboratory PXRD stoichiometry series

2022 · From 2D to 3D: Postsynthetic Pillar Insertion in Electrically Conductive MOF

Cu-THQ-BPY, Cu2+:BPY feed ratio 1:1 · Powder · BPY insertion products with Cu2+:BPY feed ratios of 2:1, 1:1 and 1:2, lambda = 1.54 Angstrom in the discussion of the diagnostic d101 peak.

Diffraction StructurePowderRefinement

Synchrotron powder X-ray diffraction and Pawley refinement

2022 · From 2D to 3D: Postsynthetic Pillar Insertion in Electrically Conductive MOF

Cu-THQ-BPY, Cu2+:BPY feed ratio 2:1 · Powder · PXRD collected at beamline 17-BM, Advanced Photon Source, lambda = 0.45237 Angstrom; compared with parent Cu-THQ and simulated Cu-THQ-BPY.

Diffraction StructureUnspecified subtype

X-ray diffraction (Cu K alpha)

2022 · Hierarchical 3D micro-nanostructures based on in situ deposited bimetallic metal-organic structures on carbon fabric for supercapacitor applications

NZMF powder / pristine bimetallic MOF · Powder · XRD patterns compared for NMF, NZMF and NZMF/CF.

Diffraction StructurePowderRefinement

Powder X-ray diffraction using Cu K alpha radiation; comparison with simulated eclipsed AA and staggered AB models; Pawley refinement

2022 · High efficient solid-phase microextraction based on a covalent organic framework for determination of trifluralin and chlorpyrifos in water and food samples by GC-CD-IMS

Synthesised PTA/TAPTT COF powder · Powder · PXRD patterns collected in the 1-10 deg range; simulations calculated using Materials Studio 6.0.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha1 radiation

2022 · High performance Li-, Na-, and K-ion storage in electrically conducting coordination polymers

pristine A2-TM-PTtSA powder set · Powder · PXRD patterns collected on a STOE DARMSTADT StadiP transmission diffractometer with wavelength 1.54059 A.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2022 · High performance Li-, Na-, and K-ion storage in electrically conducting coordination polymers

Li2-o-Co-PDSA single crystal · Single Crystal · Single crystal structure determination of Li2-Co(II)-[o-PDSA]2 model complex.

Diffraction StructureUnspecified subtype

XRD, FT-IR, ICP-OES and XPS characterisation

2022 · High-Entropy Metal-Organic Framework Arrays Boost Oxygen Evolution Electrocatalysis

HE-MOF nanosheet array electrode on nickel foam · Electrode · As-prepared HE-MOF compared with Ni-MOF and ligand; XPS Al K alpha, 0-1400 eV.

Microscopy MorphologyUnspecified subtype

SEM and XRD of perovskite films

2022 · High-Hole-Mobility Metal–Organic Framework as Dopant-Free Hole Transport Layer for Perovskite Solar Cells

Perovskite films deposited on Ni3(HITP)2 thickness series · Thin Film · Perovskite films deposited on Ni3(HITP)2 films of different thicknesses.

Diffraction StructureUnspecified subtype

X-ray diffraction

2022 · High-Hole-Mobility Metal–Organic Framework as Dopant-Free Hole Transport Layer for Perovskite Solar Cells

Ni3(HITP)2 film on ITO-coated glass · Thin Film · Ni3(HITP)2 film; instrument listed as D8 Advance (Bruker).

OtherPowder

thermogravimetric analysis and chemical stability PXRD

2022 · Highly Effective Generation of Singlet Oxygen by an Imidazole-Linked Robust Photosensitizing Covalent Organic Framework

activated PyPor-COF · Powder · TGA under N2 from room temperature to 800 deg C at 10 deg C min-1; PXRD after immersion in acid/base/organic/aqueous solutions.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Host-guest molecular interaction promoted urea electrosynthesis over a precisely designed conductive metal-organic framework

Co-PMDA-2-mbIM powder · Powder · X'PERT PRO MPD, Cu Kalpha radiation, lambda 0.15418 nm, 2-90 deg scan range; compared with simulated patterns for Co-PMDA and Co-PMDA-2-mbIM.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; CIF refinement

2022 · Host-guest molecular interaction promoted urea electrosynthesis over a precisely designed conductive metal-organic framework

Co-PMDA-2-mbIM powder · Powder · Mo Kalpha radiation, wavelength 0.71073 A; measurement temperature 291 K.

Diffraction StructureSingle crystal

Single-crystal XRD structural analysis

2022 · Host-guest molecular interaction promoted urea electrosynthesis over a precisely designed conductive metal-organic framework

Co-PMDA-2-mbIM powder · Powder · Layer, interlayer and bridge distances interpreted from the crystal structure.

SpectroscopyPowder

PXRD and EDS of metalated Cu-HHTP control

2022 · Imparting Functionality and Enhanced Surface Area to a 2D Electrically Conductive MOF via Macrocyclic Linker

Ni-metalated Cu-HHTP control · Powder · Cu-HHTP subjected to Ni or Co metalation; PXRD and EDS tables compare resulting control materials.

Diffraction StructurePowder

PXRD after pH soaking

2022 · Imparting Functionality and Enhanced Surface Area to a 2D Electrically Conductive MOF via Macrocyclic Linker

Pristine Cu-HHTC synthesised at 50 C for 8 h · Powder · Approximately 6 mg MOF stirred in about 10 mL aqueous pH 3, 5, 7, or 11 solution at room temperature for 1 h, recovered, washed with acetone and dried at 70 C.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2022 · In-Built Fabrication of MOF Assimilated Porous Hollow Carbon from Pre-Hydrolysate for Supercapacitor

C1-ZIF-67 powder · Powder · Bruker D4 powder XRD with Cu Kalpha radiation at 40 kV and 40 mA.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2022 · In-Built Fabrication of MOF Assimilated Porous Hollow Carbon from Pre-Hydrolysate for Supercapacitor

C2-ZIF-67 powder · Powder · Bruker D4 powder XRD with Cu Kalpha radiation at 40 kV and 40 mA.

Diffraction StructurePowder

PXRD

2022 · In-Plane Oriented Two-Dimensional Conjugated Metal-Organic Framework Films for High-Performance Humidity Sensing

HAB-Cu/SDS intermediate · Powder · Cu-Kalpha radiation, room temperature; HAB-Cu/SDS at cSDS = 0.85 mM and 8.5 mM compared with HAB-Cu.

Diffraction StructureGrazing incidence

GIWAXS

2022 · In-Plane Oriented Two-Dimensional Conjugated Metal-Organic Framework Films for High-Performance Humidity Sensing

free-standing in-plane oriented HIB-Cu film · Thin Film · Beamline XRD1; 12.398 keV, lambda = 1 A, grazing incidence angle 0.13 degrees.

Diffraction StructurePowderSingle crystal

powder X-ray diffraction; experimental pattern compared with simulated pattern from single-crystal CIF data

2022 · Insight into charge transportation in cadmium based semiconducting organic-inorganic hybrid materials and their application in the fabrication of photosensitive Schottky devices

bulk product of complex 1 for PXRD · Powder · Bulk product PXRD; Bruker D8, Cu Kalpha, 2theta range 5-50 degrees reported in main physical measurements.

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction; SHELXT/SHELXL refinement

2022 · Insight into charge transportation in cadmium based semiconducting organic-inorganic hybrid materials and their application in the fabrication of photosensitive Schottky devices

single crystals of complex 1 · Single Crystal · Bruker D8 QUEST area detector, Mo Kalpha radiation, 293 K; CCDC 2127905.

Diffraction StructurePowderSingle crystal

powder X-ray diffraction; experimental pattern compared with simulated pattern from single-crystal CIF data

2022 · Insight into charge transportation in cadmium based semiconducting organic-inorganic hybrid materials and their application in the fabrication of photosensitive Schottky devices

bulk product of complex 2 for PXRD · Powder · Bulk product PXRD; Bruker D8, Cu Kalpha, 2theta range 5-50 degrees reported in main physical measurements.

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction; SHELXT/SHELXL refinement

2022 · Insight into charge transportation in cadmium based semiconducting organic-inorganic hybrid materials and their application in the fabrication of photosensitive Schottky devices

single crystals of complex 2 · Single Crystal · Rigaku Mercury 375/M CCD, Mo Kalpha radiation, 293 K; CCDC 2127904.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2022 · Iodine-induced electrical conductivity of novel columnar lanthanide metal-organic frameworks based on a butterfly-shaped π-extended tetrathiafulvalene ligand

iodine-treated Tb-MOF bulk powder · Powder · Iodine-treated Tb-MOF PXRD compared with pristine and simulated patterns.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2022 · Iodine-induced electrical conductivity of novel columnar lanthanide metal-organic frameworks based on a butterfly-shaped π-extended tetrathiafulvalene ligand

pristine Tb-MOF bulk powder/crystals · Powder · Rigaku Ultima IV X-ray diffractometer with Cu Kalpha radiation, lambda = 1.5406 Angstrom, CCD area detector.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SXRD)

2022 · Iodine-induced electrical conductivity of novel columnar lanthanide metal-organic frameworks based on a butterfly-shaped π-extended tetrathiafulvalene ligand

pristine Er-MOF crystals/powder · Powder · Bruker/SHELXTL single-crystal structure refinement with Multi-Scan absorption correction.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SXRD)

2022 · Iodine-induced electrical conductivity of novel columnar lanthanide metal-organic frameworks based on a butterfly-shaped π-extended tetrathiafulvalene ligand

pristine Eu-MOF crystals/powder · Powder · Bruker/SHELXTL single-crystal structure refinement.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SXRD)

2022 · Iodine-induced electrical conductivity of novel columnar lanthanide metal-organic frameworks based on a butterfly-shaped π-extended tetrathiafulvalene ligand

pristine Tb-MOF bulk powder/crystals · Powder · Bruker D8 Venture dual source diffractometer; structure solved/refined with Bruker SHELXTL package.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2022 · Iron-Based 2D Conductive Metal-Organic Framework Nanostructure with Enhanced Pseudocapacitance

Fe-HHTP powder · Powder · Cu-sealed tube, lambda = 1.5418 A, 40 kV, 40 mA; structure simulated in Materials Studio Forcite and refined using GSAS-II.

Diffraction StructurePowder

PXRD-supported structural modelling

2022 · Iron-Based 2D Conductive Metal-Organic Framework Nanostructure with Enhanced Pseudocapacitance

Fe-HHTP powder · Powder · Assignment of pore diameter, interlayer spacings and DMF-coordinated layer motifs from PXRD and simulated structure.

Diffraction StructurePowder

PXRD before and after CV stability test

2022 · Iron-Based 2D Conductive Metal-Organic Framework Nanostructure with Enhanced Pseudocapacitance

Fe-HHTP composite working electrode · Electrode · Electrode material scraped after electrochemical measurements, dispersed in acetone, retrieved by centrifugation and measured by PXRD.

Diffraction StructurePowder

PXRD compared with simulated pattern

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TBCP-MOF crystals · Single Crystal · as-synthesised sample; Cu Kα wavelength 1.5406 Å in captions

Diffraction StructurePowder

PXRD compared with simulated pattern

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TBML-MOF crystals · Single Crystal · as-synthesised sample; Cu Kα wavelength 1.5406 Å in captions

Diffraction StructurePowder

PXRD compared with simulated pattern

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TML-MOF crystals · Single Crystal · as-synthesised sample; Cu Kα wavelength 1.5406 Å in captions

Diffraction StructurePowder

PXRD compared with simulated pattern

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TM-MOF crystals · Single Crystal · as-synthesised sample; Cu Kα wavelength 1.5406 Å in captions

Diffraction StructurePowder

PXRD compared with simulated pattern

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TNP-MOF crystals · Single Crystal · as-synthesised sample; Cu Kα wavelength 1.5406 Å in captions

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TBCP-MOF crystals · Single Crystal · solvent molecules removed using SQUEEZE routine of PLATON

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TBML-MOF crystals · Single Crystal · solvent molecules removed using SQUEEZE routine of PLATON

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TML-MOF crystals · Single Crystal · solvent molecules removed using SQUEEZE routine of PLATON

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TM-MOF crystals · Single Crystal · solvent molecules removed using SQUEEZE routine of PLATON

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Large π-Conjugated Metal-Organic Frameworks for Infrared-Light-Driven CO2Reduction

TNP-MOF crystals · Single Crystal · solvent molecules removed using SQUEEZE routine of PLATON

Diffraction StructurePowder

SEM and PXRD

2022 · Large-Area Synthesis of Ultrathin, Flexible, and Transparent Conductive Metal–Organic Framework Thin Films via a Microfluidic-Based Solution Shearing Process

MASS-PRC Co3(HITP)2 thin film · Thin Film · Co3(HITP)2 thin film made by MASS-PRC; powder pattern obtained by scraping film multiple times.

Diffraction StructurePowderGrazing incidence

GIXD on thin film and PXRD on powder scraped from films

2022 · Large-Area Synthesis of Ultrathin, Flexible, and Transparent Conductive Metal–Organic Framework Thin Films via a Microfluidic-Based Solution Shearing Process

MASS-PRC Ni3(HITP)2 thin film · Thin Film · Thin film on SiO2 wafer for GIXD; powder collected by scraping thin film multiple times for PXRD.

Electrochemistry ApplicationUnspecified subtype

moisture ageing photographs, UV-vis and XRD

2022 · Li-TFSI endohedral Metal-Organic frameworks in stable perovskite solar cells for Anti-Deliquescent and restricting ion migration

PSC with Li-TFSI@NH2-MIL-101 doped HTL · Electrode · ambient environment at 90% RH and room temperature; ageing 0, 3, 5 and 12 h in Fig. 6a

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Li-TFSI endohedral Metal-Organic frameworks in stable perovskite solar cells for Anti-Deliquescent and restricting ion migration

Li-TFSI@NH2-MIL-101 powder · Powder · PXRD comparison of pristine and guest-loaded MOF

Diffraction StructurePowder

powder XRD (PANalytical Empyrean)

2022 · Metal organic frameworks (MOFs) as potential anode materials for improving power generation from algal biophotovoltaic (BPV) platforms

as-formulated Cu-MOF · Powder · Crystalline structures scrutinised using XRD patterns.

Diffraction StructurePowder

powder XRD (PANalytical Empyrean)

2022 · Metal organic frameworks (MOFs) as potential anode materials for improving power generation from algal biophotovoltaic (BPV) platforms

as-formulated Cu-Ni MOF · Powder · XRD comparison of mixed-metal Cu-Ni MOF against Cu-MOF.

Diffraction StructurePowder

powder X-ray diffraction

2022 · Metal-Organic Framework Assembled on Oriented Nanofiber Arrays for Field-Effect Transistor and Gas Sensor-Based Applications

Cu3(HITP)2 NFAs on PDMS-PCDA/Cu, 500 r/min · Electrode · Simulated Cu3(HITP)2 compared with Cu3(HITP)2 powder and PDMS-PCDA/Cu3(HITP)2 NFAs.

Diffraction StructurePowder

powder X-ray diffraction comparison

2022 · Microscopic Insights into Cation-Coupled Electron Hopping Transport in a Metal-Organic Framework

Zr(dcphOH-NDI)@FTO thin-film electrodes · Electrode · Experimental Zr(dcphOH-NDI)@FTO powder pattern compared with simulated Zr(dcphOH-NDI) 3DED powder pattern and SnO2/FTO pattern.

Diffraction StructurePowder

PXRD after air exposure

2022 · Millimeter-scale semiconductive metal-organic framework single crystal for X-ray imaging

SCU-15 crystals · Single Crystal · SCU-15 crystals tested after two months in moist air.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Millimeter-scale semiconductive metal-organic framework single crystal for X-ray imaging

SCU-15 crystals · Single Crystal · Bruker D8 Advance diffractometer, Cu Ka radiation (lambda = 1.54056 A), 5-50 deg 2theta.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SC-XRD)

2022 · Millimeter-scale semiconductive metal-organic framework single crystal for X-ray imaging

SCU-15 crystals · Single Crystal · Bruker D8-Venture diffractometer, Mo Ka radiation (lambda = 0.71073 A), CMOS detector, 296 K.

Microscopy MorphologyUnspecified subtype

SI XRD, FT-IR, SEM and TEM rendered-page review

2022 · Morphologies of thienyl based bimetallic metal-organic frameworks controlled by solvents for high specific capacitance supercapacitor

PTA-NC MOF · Powder · PTA-NC MOF comparison sample characterised by XRD (Fig. S1), FT-IR (Fig. S2), SEM (Fig. S3) and TEM (Fig. S4).

Diffraction StructurePowder

Powder X-ray diffraction (D8 DISCOVER A25)

2022 · Morphologies of thienyl based bimetallic metal-organic frameworks controlled by solvents for high specific capacitance supercapacitor

E-NCT MOF · Nanosheet · XRD patterns compared for E/M/D-NCT MOF; PTA-NC XRD is shown in SI Figure S1.

Diffraction StructurePowder

Powder X-ray diffraction after grinding

2022 · Multi-stimulus semiconductor Cu(i)-I-pyrimidine coordination polymer with thermo- and mechanochromic sensing

CP1 ground powder series · Powder · PXRD compared at 0 min and 15 min grinding in SI Fig. S5.

Diffraction StructureSingle crystal

High-pressure single-crystal X-ray diffraction and Birch-Murnaghan EoS fitting

2022 · Multi-stimulus semiconductor Cu(i)-I-pyrimidine coordination polymer with thermo- and mechanochromic sensing

CP1 colourless needle-shaped single crystals · Single Crystal · Rigaku SuperNOVA microfocused Mo X-rays; Bragg mini-DAC with 500 um culets; methanol-ethanol 4:1 pressure medium; pressure increased from 0 to 9 GPa; BM3 EoS fitted with EosFit7-GUI.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Multi-stimulus semiconductor Cu(i)-I-pyrimidine coordination polymer with thermo- and mechanochromic sensing

CP1 precipitated bulk solid / polycrystalline powder · Powder · PANalytical X'Pert PRO; theta/2theta scan from 3-60 degrees; angular increase 0.0167; 100 s per increment.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2022 · Multi-stimulus semiconductor Cu(i)-I-pyrimidine coordination polymer with thermo- and mechanochromic sensing

CP1 colourless needle-shaped single crystals · Single Crystal · Bruker Kappa Apex II, graphite-monochromated Mo Kalpha radiation (lambda = 0.71073 A); structures determined at 296 K and 100/110 K.

Diffraction StructureUnspecified subtype

X-ray diffraction

2022 · Nanostructured Conductive Metal Organic Frameworks for Sustainable Low Charge Overpotentials in Li–Air Batteries

discharged Cu-THQ/GDE cathode · Electrode · Bruker D8 Advance, 40 kV, 40 mA, Cu K-alpha; pristine/10th discharge and deep discharge cathodes

Diffraction StructurePowder

post-OER PXRD

2022 · Ni(II)-Based Coordination Polymer with Pi-Conjugated Organic Linker as Catalyst for Oxygen Evolution Reaction Activity

CP 1 catalyst ink drop-cast on glassy carbon electrode · Electrode · PXRD pattern of CP 1 before and after OER analysis.

Diffraction StructurePowder

powder X-ray diffraction

2022 · Ni(II)-Based Coordination Polymer with Pi-Conjugated Organic Linker as Catalyst for Oxygen Evolution Reaction Activity

as-synthesised CP 1 blue needle-shaped crystals · Single Crystal · Rigaku Smart Lab; Cu-Kalpha; 2theta 5 to 50 degrees; room temperature.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Ni(II)-Based Coordination Polymer with Pi-Conjugated Organic Linker as Catalyst for Oxygen Evolution Reaction Activity

as-synthesised CP 1 blue needle-shaped crystals · Single Crystal · Agilent Supernova diffractometer; Cu Kalpha radiation; structure solved with SHELXS/SHELXL and Olex2; PLATON/SQUEEZE used for disordered solvent.

Diffraction StructurePowder

powder X-ray diffraction

2022 · Ni(II)-Based Coordination Polymer with Pi-Conjugated Organic Linker as Catalyst for Oxygen Evolution Reaction Activity

as-synthesised CP 2 blue crystals · Single Crystal · PXRD pattern of CP 2 compared with simulated CP 2.

Diffraction StructurePowder

PXRD chemical stability test

2022 · Nickel(II) Cluster-Based Pillar-Layered Metal-Organic Frameworks for High-Performance Supercapacitors

acid/base-treated Ni-mba-Na and Ni-mba-K powders · Powder · ~100 mg suspended in saturated NH4OH, saturated KOH or 1 M HCl for 24 h, washed, dried at 60 deg C for 24 h, then PXRD.

Diffraction StructurePowder

PXRD/SXRD comparison and Table S1 distances

2022 · Nickel(II) Cluster-Based Pillar-Layered Metal-Organic Frameworks for High-Performance Supercapacitors

as-synthesised Ni-mba-K product · Powder · Detailed Ni-mba-K characterisation reported in SI; Table S1 provides bond distances/angle.

Diffraction StructurePowder

SXRD/PXRD structural interpretation and Table S1 distances

2022 · Nickel(II) Cluster-Based Pillar-Layered Metal-Organic Frameworks for High-Performance Supercapacitors

as-synthesised Ni-mba-Na black fibrous product · Powder · Single-crystal diffraction on Bruker Smart-1000 CCD; PXRD/SXRD comparison; structural distances listed in SI Table S1.

Electrochemistry ApplicationUnspecified subtype

Cyclic voltammetric stability scan plus SEM/XRD checks

2022 · NiPd mediated by conductive metal organic frameworks with facilitated electron transfer for assaying of H2O2 released from living cells

Ni3HHTP2/GC · Electrode · Ni3HHTP2/GC electrochemically scanned in 10 mM PBS (pH 7.4) for 24 h.

Diffraction StructureUnspecified subtype

X-ray diffraction

2022 · NiPd mediated by conductive metal organic frameworks with facilitated electron transfer for assaying of H2O2 released from living cells

NiPd@Ni3HHTP2 hybrid nanomaterials · Unknown · XRD of NiPd@Ni3HHTP2 hybrid and consistency check across 10 aliquots.

Diffraction StructurePowder

Powder X-ray diffraction (Cu source)

2022 · NiPd mediated by conductive metal organic frameworks with facilitated electron transfer for assaying of H2O2 released from living cells

Ni3HHTP2 powder · Powder · pXRD pattern of pristine Ni3HHTP2.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2022 · One-step electrochemical synthesis of tremella-like Co-MOFs/carbon nanohorns films for enhanced electrochemical sensing of carbendazim in vegetable and fruit samples

Co-MOFs/CNHs/GCE composite sensing electrode · Electrode · XRD patterns for Co-MOFs, CNHs, and Co-MOFs/CNHs compared with simulated Co-MOFs.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2022 · One-Step Solvothermal Synthesis of Raspberry-like NiCo-MOF for High-Performance Flexible Supercapacitors for a Wide Operation Temperature Range

NiCo-MOF-3 powder · Powder · Crystalline structures of Ni-MOF, Co-MOF, and NiCo-MOF-1/2/3/4 compared.

Diffraction StructurePowder

PXRD

2022 · Operando Elucidation of Electrocatalytic and Redox Mechanisms on a 2D Metal Organic Framework Catalyst for Efficient Electrosynthesis of Hydrogen Peroxide in Neutral Media

Ni-HAB powder · Powder · Cu Kalpha PXRD comparing Ni-HAB, Ni-HITP and Cu-HAB powders; Ni-HAB compared with simulated pattern in main Figure 1d.

Diffraction StructurePowder

PXRD/XPS after H2O2 chemical stability tests

2022 · Operando Elucidation of Electrocatalytic and Redox Mechanisms on a 2D Metal Organic Framework Catalyst for Efficient Electrosynthesis of Hydrogen Peroxide in Neutral Media

Ni-HAB powder · Powder · Ni-HAB powder stirred for about 15 h in 0.1 wt.% and 1 wt.% H2O2, then centrifuged, dried and measured by PXRD and XPS.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Oxidative control over the morphology of Cu3(HHTP)2, a 2D conductive metal-organic framework

Cu3(HHTP)2 air-synthesis particles · Powder · Dropcast acetone suspensions onto silicon wafers and slowly evaporated.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Oxidative control over the morphology of Cu3(HHTP)2, a 2D conductive metal-organic framework

Cu3(HHTP)2 air-synthesis rods · Powder · Dropcast acetone suspensions onto silicon wafers and slowly evaporated.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Oxidative control over the morphology of Cu3(HHTP)2, a 2D conductive metal-organic framework

Cu3(HHTP)2 blocks, 0.3 equiv 2,5-dichloro pre-oxidant · Powder · Dropcast acetone suspensions onto silicon wafers and slowly evaporated.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Oxidative control over the morphology of Cu3(HHTP)2, a 2D conductive metal-organic framework

Cu3(HHTP)2 flakes, 0.5 equiv 2,5-dichloro pre-oxidant · Powder · Dropcast acetone suspensions onto silicon wafers and slowly evaporated.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Oxidative control over the morphology of Cu3(HHTP)2, a 2D conductive metal-organic framework

No-oxidant Cu/HHTP mixed-phase control · Powder · Dropcast acetone suspensions onto silicon wafers and slowly evaporated.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Oxidative control over the morphology of Cu3(HHTP)2, a 2D conductive metal-organic framework

Cu3(HHTP)2 rods, 0 equiv pre-oxidant · Powder · Dropcast acetone suspensions onto silicon wafers and slowly evaporated.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Pd-Embedded Ti Metal–Organic Framework Nanostructures for Photocatalytic Reductive N-Formylation of Nitroarenes in Water

Pd1.5%/Ti-MOF · Powder · PXRD of Pd/Ti-MOF loading series compared with Ti-MOF.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Pd-Embedded Ti Metal–Organic Framework Nanostructures for Photocatalytic Reductive N-Formylation of Nitroarenes in Water

Ti-MOF · Powder · PXRD pattern compared with simulated Ti-MOF pattern/card no. 7211159.

Diffraction StructurePowder

PXRD and FE-SEM of spent catalyst

2022 · Pd-Embedded Ti Metal–Organic Framework Nanostructures for Photocatalytic Reductive N-Formylation of Nitroarenes in Water

spent Pd1.5%/Ti-MOF after recycling · Powder · Spent Pd1.5%/Ti-MOF after recycling compared with fresh catalyst.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2022 · Phthalocyanine-Based Two-Dimensional Conductive Metal-Organic Framework as Electrochemical Sensor for Highly Sensitive Detection of Nifedipine

CoPc-Cu MOF black powder · Powder · Powder XRD pattern used to assign periodic structure of CoPc-Cu MOF.

Diffraction StructurePowderRefinement

Pawley refinement of PXRD

2022 · Precise tuning of interlayer electronic coupling in layered conductive metal-organic frameworks

Ni3(HATI_C1)2 black powder · Powder · Refined in BIOVA Materials Studio Reflex, 2theta 2.5-40 deg, fixed atom coordinates, pseudo-Voigt profile.

Diffraction StructurePowderRefinement

Pawley refinement of PXRD

2022 · Precise tuning of interlayer electronic coupling in layered conductive metal-organic frameworks

Ni3(HATI_C3)2 black powder · Powder · Refined in BIOVA Materials Studio Reflex, 2theta 2.5-40 deg, fixed atom coordinates, pseudo-Voigt profile.

Diffraction StructurePowderRefinement

Pawley refinement of PXRD

2022 · Precise tuning of interlayer electronic coupling in layered conductive metal-organic frameworks

Ni3(HATI_C4)2 black powder · Powder · Refined in BIOVA Materials Studio Reflex, 2theta 2.5-40 deg, fixed atom coordinates, pseudo-Voigt profile.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Precise tuning of interlayer electronic coupling in layered conductive metal-organic frameworks

Ni3(HATI_C1)2 black powder · Powder · Cu Kalpha radiation; room-temperature reflection geometry; optimal synthesis condition where applicable.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Precise tuning of interlayer electronic coupling in layered conductive metal-organic frameworks

Ni3(HATI_C2)2 black powder · Powder · Cu Kalpha radiation; room-temperature reflection geometry; optimal synthesis condition where applicable.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Precise tuning of interlayer electronic coupling in layered conductive metal-organic frameworks

Ni3(HATI_C3)2 black powder · Powder · Cu Kalpha radiation; room-temperature reflection geometry; optimal synthesis condition where applicable.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Precise tuning of interlayer electronic coupling in layered conductive metal-organic frameworks

Ni3(HATI_C4)2 black powder · Powder · Cu Kalpha radiation; room-temperature reflection geometry; optimal synthesis condition where applicable.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Precise tuning of interlayer electronic coupling in layered conductive metal-organic frameworks

Ni3(HATI_C8)2 black powder · Powder · Cu Kalpha radiation; room-temperature reflection geometry; optimal synthesis condition where applicable.

Diffraction StructurePowder

powder XRD

2022 · Preparation of Bimetallic Conductive Metal-organic Framework Material Ni/Co-CAT for Electrocatalytic Oxygen Reduction 双金属导电金属有机框架材料 Ni/Co-CAT 的制备及其氧还原催化性能研究

Ni-Co-CAT powder · Powder · Bruker TTR3, Cu Kα radiation (λ = 0.15418 nm), 40 kV, 40 mA.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Rigaku Ultima IV

2022 · Probing the electronic and ionic transport in topologically distinct redox-active metal-organic frameworks in aqueous electrolytes

All powder materials: MOF-808, Mn-MOF-808, UiO-66, Mn-UiO-66, CAU-24 and Mn-CAU-24 · Powder · PXRD patterns of all pristine and Mn-decorated powders compared with simulated patterns.

Diffraction StructurePowder

PXRD

2022 · Quasi Solid–Liquid Reaction Strategy to In Situ Synthesize the Conductive MOF Film with Ordered Submicron Macropores for Gas Sensing

TOM-Cu3(HITP)2 film for spectroscopic characterisations · Thin Film · Rigaku SmartLab with Cu K alpha X-ray source; TOM-Cu3(HITP)2 film on quartz compared with ordinary Cu3(HITP)2 MOF.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu-Kalpha

2022 · Rational synthesis of a pyridyl-imidazoquinazoline based multifunctional 3D Zn(ii)-MOF: structure, luminescence, selective and sensitive detection of Al3+ and TNP, and its semiconducting device application

As-synthesised bulk material of 1 · Powder · Ambient temperature; 2theta 5-50 deg; as-synthesised powder compared with simulated single-crystal pattern and acid-treated sample

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Bruker SMART APEX II CCD, Mo Kalpha

2022 · Rational synthesis of a pyridyl-imidazoquinazoline based multifunctional 3D Zn(ii)-MOF: structure, luminescence, selective and sensitive detection of Al3+ and TNP, and its semiconducting device application

Yellow block-shaped crystals of 1 · Single Crystal · Single crystal immersed in oil; data collected at 273 K; SHELXT/Olex2 refinement

Diffraction StructurePowder

powder X-ray diffraction

2022 · Redox-Active Metal-Organic Frameworks with Three-Dimensional Lattice Containing the m-Tetrathiafulvalene-Tetrabenzoate

Tb-m-TTFTB polycrystalline/powder sample · Powder · Room-temperature PXRD at 0.1 s/step on Bruker Advance D8 with Cu radiation; calculated PXRD generated using Mercury 3.0. Figure compares Tb/Er/Gd patterns to Tb simulation.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Redox-Active Metal-Organic Frameworks with Three-Dimensional Lattice Containing the m-Tetrathiafulvalene-Tetrabenzoate

Er-m-TTFTB red rod-like/needle-like single crystal · Single Crystal · Bruker D8 Venture, Mo Kalpha radiation, lambda = 0.71073 A; 153 K; SHELXTL/PLATON SQUEEZE refinement.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Redox-Active Metal-Organic Frameworks with Three-Dimensional Lattice Containing the m-Tetrathiafulvalene-Tetrabenzoate

Gd-m-TTFTB red rod-like/needle-like single crystal · Single Crystal · Bruker D8 Venture, Mo Kalpha radiation, lambda = 0.71073 A; 153 K; SHELXTL/PLATON SQUEEZE refinement.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Redox-Active Metal-Organic Frameworks with Three-Dimensional Lattice Containing the m-Tetrathiafulvalene-Tetrabenzoate

Tb-m-TTFTB red rod-like/needle-like single crystal · Single Crystal · Bruker D8 Venture, Mo Kalpha radiation, lambda = 0.71073 A; nitrogen-flow low-temperature attachment at 153 K; SHELXTL/PLATON SQUEEZE refinement.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Redox-Active Ni(II) Nodes Induced Electrochromism in a Two-Dimensional Conductive Metal-Organic Framework

Ni3(HITP)2 precipitate/powder · Powder · Measured using a Rigaku D/MAX 2550 V diffractometer with radiation at 40 kV and 200 mA.

SpectroscopyUnspecified subtype

FT-IR, XRD and XPS survey spectra

2022 · Self-supporting electrochemical sensors for monitoring of cell-released H2O2 based on metal nanoparticle/MOF nanozymes

As-synthesised 2D Zn-MOF nanosheet powder · Nanosheet · Component, crystallinity and elemental valence/survey analysis of 2D and 3D Zn-MOFs.

Diffraction StructureUnspecified subtype

SEM and out-of-plane XRD

2022 · Sensitive Detection of Alcohol Isomers by Ionically Conductive Metal-Organic Frameworks

Co-TCPP device without mobile metal ions on conductive glass · Electrode · Co-TCPP MOF thin film without mobile metal ions.

Diffraction StructureUnspecified subtype

Out-of-plane XRD

2022 · Sensitive Detection of Alcohol Isomers by Ionically Conductive Metal-Organic Frameworks

Co-TCPP IC-MOF capacitive sensor on ITO interdigital electrodes · Electrode · Out-of-plane profile of Co-TCPP IC-MOF thin film.

Microscopy MorphologyPowder

PXRD Scherrer analysis and SEM particle sizing

2022 · Size-Dependent Properties of Solution-Processable Conductive MOF Nanocrystals

CoTA2 bulk and nanosized series with 1-methylimidazole · Powder · Preliminary CoTA2 bulk and nanoparticle syntheses with varying 1-methylimidazole equivalents.

Microscopy MorphologyPowder

PXRD Scherrer analysis and selected SEM particle sizing

2022 · Size-Dependent Properties of Solution-Processable Conductive MOF Nanocrystals

Fe(TA)2 nanoparticles made with alternate modulators · Powder · Exploratory Fe(TA)2 syntheses with 5-bromo-1-methylimidazole, 1-benzyl-2-methylimidazole and n-butylamine.

Diffraction StructurePowder

Le Bail fitting of PXRD patterns in GSAS-II

2022 · Size-Dependent Properties of Solution-Processable Conductive MOF Nanocrystals

Fe(TA)2 nanoparticle series synthesised with 1-methylimidazole · Powder · Largest and smallest Fe(TA)2 nanoparticles fitted with instrumental broadening from Al2O3 standard.

Microscopy MorphologyPowder

SEM particle sizing and PXRD Scherrer analysis

2022 · Size-Dependent Properties of Solution-Processable Conductive MOF Nanocrystals

Fe(TA)2 nanoparticle series synthesised with 1-methylimidazole · Powder · SEM samples drop-cast from DMF onto silicon and dried under N2; >200 particles measured when SEM-resolved. Scherrer analysis from PXRD for all sizes.

Diffraction StructurePowder

PXRD

2022 · Solvent-controlled ion-coupled charge transport in microporous metal chalcogenides

TMA2FeGe4S10 microcrystalline powder · Powder · PXRD phase-purity check for TMA2FeGe4S10 and TMA2ZnGe4S10 powders.

Diffraction StructurePowder

PXRD

2022 · Solvent-controlled ion-coupled charge transport in microporous metal chalcogenides

TMA4Ge4S10 off-white precursor powder · Powder · Experimental powder XRD compared with simulated TMA4Ge4S10.

Diffraction StructurePowderRefinement

PXRD and Rietveld refinement

2022 · sp-Carbon Incorporated Conductive Metal-Organic Framework as Photocathode for Photoelectrochemical Hydrogen Generation

as-synthesised Cu3HHAE2 powder/hexagonal rods · Powder · Cu-Kalpha radiation, transmission geometry at room temperature; experimental PXRD refined against model derived from cRED.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2022 · Split-cell symmetric supercapacitor performance of bimetallic MOFs yolk-shell hierarchical microstructure

Ni-Zn MOF precipitate / powder · Powder · Powder XRD profile of Ni-Zn MOF; SI reports PANalytical Xpert Pro MRD with Cu Kalpha radiation (1.5406 Angstrom). Fig. 1a visible range approximately 7-50 deg 2theta.

Diffraction StructureUnspecified subtype

XRD before/after field-emission test

2022 · Stacked conductive metal–organic framework nanorods for high-performance vacuum electronic devices

Cu-CAT@GP field-emission device cathode · Electrode · XRD comparison of Cu-CAT@GP cathode before and after field-emission testing.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD with Cu Kalpha; Empyrean)

2022 · Stacked conductive metal–organic framework nanorods for high-performance vacuum electronic devices

Cu-CAT nanorods grown on graphite paper · Electrode · XRD pattern of Cu-CAT nanorods on graphite paper compared with Cu-CAT powder and simulated diffraction peaks.

Diffraction StructurePowder

Synchrotron powder X-ray diffraction reanalysis with DIFFaX stacking-fault modelling

2022 · Structural, Thermodynamic, and Transport Properties of the Small-Gap Two-Dimensional Metal-Organic Kagomé Materials Cu3(hexaiminobenzene)2and Ni3(hexaiminobenzene)2

Cu3(HIB)2 powder · Powder · Previously reported synchrotron XRD data at lambda = 0.517045 A and 100 K; models constructed from previously reported CIF files; finite particle size effects included.

Diffraction StructurePowder

Synchrotron powder X-ray diffraction reanalysis with DIFFaX stacking-fault modelling

2022 · Structural, Thermodynamic, and Transport Properties of the Small-Gap Two-Dimensional Metal-Organic Kagomé Materials Cu3(hexaiminobenzene)2and Ni3(hexaiminobenzene)2

Ni3(HIB)2 powder · Powder · Previously reported synchrotron XRD data at lambda = 0.517045 A and 100 K; models constructed from previously reported CIF files; finite particle size effects included.

Diffraction StructurePowder

IR, TG, PXRD, SEM and EDS mapping

2022 · Supramolecular Host-Guest Assembly Based on Phosphotungstate Nanostructures for Pseudocapacitive and Electrochemical Sensing Applications

Compound 2 · Single Crystal · Characterisation of compounds 1 and 2; exact plots in SI Figures S8-S11.

Diffraction StructurePowder

powder X-ray diffraction

2022 · Supramolecular Host-Guest Assembly Based on Phosphotungstate Nanostructures for Pseudocapacitive and Electrochemical Sensing Applications

Compound 2 · Single Crystal · Cu Kalpha radiation, 2theta 5-50 deg; experimental vs simulated patterns for compounds 1 and 2.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Supramolecular Host-Guest Assembly Based on Phosphotungstate Nanostructures for Pseudocapacitive and Electrochemical Sensing Applications

Compound 1 · Single Crystal · Bruker SMART/APEX CCD, Mo Kalpha radiation, structure refined with SHELXTL-2014; CIF for compound 1.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2022 · Supramolecular Host-Guest Assembly Based on Phosphotungstate Nanostructures for Pseudocapacitive and Electrochemical Sensing Applications

Compound 2 · Single Crystal · Bruker SMART/APEX CCD, Mo Kalpha radiation, structure refined with SHELXTL-2014; CIF for compound 2.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Kalpha radiation

2022 · Surface Structure Construction of Fibers in a Conductive Metal-Organic Framework/Metal/Cotton Electrode for Flexible Textile Supercapacitors

CPA Au-plated cotton/PDA current collector · Electrode · XRD pattern recorded on Rigaku D/Max-2550PC diffractometer.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Kalpha radiation

2022 · Surface Structure Construction of Fibers in a Conductive Metal-Organic Framework/Metal/Cotton Electrode for Flexible Textile Supercapacitors

CPAMOF Cu-MOF/Au/cotton electrode · Electrode · XRD pattern recorded on Rigaku D/Max-2550PC diffractometer.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Synergistic effect of Co/Ni bimetallic metal–organic nanostructures for enhanced electrochemical energy storage

Co/Ni-MOF-5:1 powder · Powder · Co-rich Co/Ni-MOF-5:1 compared with simulated/as-synthesised Co-MOF in SI.

OtherPowder

Post-cycling SEM, TEM, PXRD and XPS

2022 · Synergistic effect of Co/Ni bimetallic metal–organic nanostructures for enhanced electrochemical energy storage

Co/Ni-MOF-2:1 three-electrode working electrode · Electrode · Characterisation of Co/Ni-MOF-2:1 electrode after 5000 cycles.

Diffraction StructurePowder

powder X-ray diffraction (Cu Kalpha)

2022 · Synthesis of Tostadas-Shaped Metal-Organic Frameworks for Remitting Capacity Fading of Li-Ion Batteries

NHM; Tostadas-shaped Ni-HITP assembly · Powder · As-synthesised NHP, NHM, and NHS; 2theta 4-40 deg; 2 deg min-1 in SI method.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2022 · Target-triggered hybridization chain reaction for ultrasensitive dual-signal miRNA detection

Calcined N-PCD powder · Powder · XRD pattern after ZIF-8 calcination; Cu Kalpha radiation per SI.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2022 · Target-triggered hybridization chain reaction for ultrasensitive dual-signal miRNA detection

Synthesised ZIF-8 powder · Powder · XRD pattern used for ZIF-8 phase assignment; Cu Kalpha radiation per SI.

Diffraction StructureGrazing incidence

thin-film XRD and grazing-incidence XRD (GIXRD)

2022 · The Growth Mechanism of a Conductive MOF Thin Film in Spray-based Layer-by-layer Liquid Phase Epitaxy

Cu3(HHTP)2 thin film, 200 nm, XRD specimen · Thin Film · Rigaku SmartLab with Cu Kalpha radiation, lambda = 1.54 A; out-of-plane 2theta 3-30 deg, 0.1 deg min^-1, 0.02 deg step; in-plane GIXRD alpha = 0.3 deg, 2theta 3-30 deg, 0.048 deg min^-1, 0.12 deg step.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Thousand-fold increase in O2electroreduction rates with conductive MOFs

As-synthesised Co3(HITP)2 powder · Powder · As-synthesised Co3(HITP)2 and Cu3(HITP)2 powders.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2022 · Thousand-fold increase in O2electroreduction rates with conductive MOFs

As-synthesised Ni3(HITP)2 powder · Powder · As-synthesised Ni3(HITP)2 powder; Bruker Advance II, Ni-filtered Cu Kalpha radiation.

Diffraction StructurePowder

Post-electrolysis PXRD

2022 · Thousand-fold increase in O2electroreduction rates with conductive MOFs

0.4 mg cm^-2 Ni3(HITP)2 GDE · Electrode · Catalyst layer scraped from AvCarb GDE after electrolysis; compared with AvCarb microporous layer background.

Diffraction StructurePowder

PXRD, FT-IR, Raman, XPS and TGA characterisation

2022 · Tunable Capacitive Behavior in Metallopolymer-based Electrochromic Thin Film Supercapacitors

poly-Fe-L1 isolated metallopolymer powder · Powder · PXRD with Cu K-alpha radiation; FT-IR in KBr; Raman spectra; XPS with Al K-alpha; TGA in nitrogen at 10 degrees C/min

Diffraction StructurePowder

PXRD, FT-IR, Raman, XPS and TGA characterisation

2022 · Tunable Capacitive Behavior in Metallopolymer-based Electrochromic Thin Film Supercapacitors

poly-Fe-L2 isolated metallopolymer powder · Powder · PXRD with Cu K-alpha radiation; FT-IR in KBr; Raman spectra; XPS with Al K-alpha; TGA in nitrogen at 10 degrees C/min

Diffraction StructurePowder

PXRD, FT-IR, Raman, XPS and TGA characterisation

2022 · Tunable Capacitive Behavior in Metallopolymer-based Electrochromic Thin Film Supercapacitors

poly-Fe-L3 isolated metallopolymer powder · Powder · PXRD with Cu K-alpha radiation; FT-IR in KBr; Raman spectra; XPS with Al K-alpha; TGA in nitrogen at 10 degrees C/min

Diffraction StructureGrazing incidence

GIXRD before and after PMMA transfer

2022 · Tunable Carrier Type of a Semiconducting 2D Metal-Organic Framework Cu3(HHTP)2

CuHHTP-40 PMMA-transferred Cu3(HHTP)2 film · Thin Film · Transferred Cu3(HHTP)2 films dried at 40 C and 70 C compared against neat PMMA and pristine film.

Diffraction StructurePowder

powder XRD

2022 · Ultra-thin Two-Dimensional Trimetallic Metal-Organic Framework for Photocatalytic Reduction of CO2

Ni-BDC nanosheets · Nanosheet · wide-angle XRD with Cu K alpha radiation

Diffraction StructurePowder

powder XRD

2022 · Ultra-thin Two-Dimensional Trimetallic Metal-Organic Framework for Photocatalytic Reduction of CO2

NiZr-BDC nanosheets · Nanosheet · wide-angle XRD with Cu K alpha radiation

Diffraction StructurePowder

powder XRD

2022 · Ultra-thin Two-Dimensional Trimetallic Metal-Organic Framework for Photocatalytic Reduction of CO2

NiZrCu-BDC nanosheets · Nanosheet · wide-angle XRD with Cu K alpha radiation

SpectroscopyUnspecified subtype

Post-OER microscopy/XRD/XPS/XANES and in situ Raman

2022 · Ultrafast transformation of metal-organic frameworks into advanced oxygen evolution electrocatalysts with good universality and scalability

Fe-CoNi MOFs on Ni foam, 0.10 M Fe(NO3)3 · Electrode · Characterisation after 100 h at 100 mA cm^-2; Raman from OCP to 1.5 V vs RHE.

Diffraction StructureUnspecified subtype

XRD and FTIR

2022 · Ultrafast transformation of metal-organic frameworks into advanced oxygen evolution electrocatalysts with good universality and scalability

CoNi MOFs on Ni foam · Electrode · XRD and FTIR used to assign CoNi MOFs phase and crystallinity change after Fe transformation.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Ultrathin MOF nanosheet-based resistive sensors for highly sensitive detection of methanol

Co-TCPP-Ac NSs · Nanosheet · Cu-Kalpha radiation, lambda = 1.5406 A; nanosheet, bulk, and simulated patterns compared.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2022 · Ultrathin MOF nanosheet-based resistive sensors for highly sensitive detection of methanol

Co-TCPP-Ac bulk crystals · Single Crystal · Cu-Kalpha radiation, lambda = 1.54178 A, data collected at 273 K; PLATON/SQUEEZE used for disordered solvent.

Diffraction StructureGrazing incidence

GIXRD / in-plane XRD / HRTEM

2022 · Ultrathin Self-Assembly Two-Dimensional Metal-Organic Framework Films as Hole Transport Layers in Ideal-Bandgap Perovskite Solar Cells

ultrathin Cu3(HHTT)2 film on ITO · Thin Film · Out-of-plane and in-plane XRD patterns plus HRTEM of Cu3(HHTT)2 film/grain.

Diffraction StructureUnspecified subtype

SEM, XRD, Williamson-Hall analysis and UV-vis/Tauc

2022 · Ultrathin Self-Assembly Two-Dimensional Metal-Organic Framework Films as Hole Transport Layers in Ideal-Bandgap Perovskite Solar Cells

FA0.83Cs0.17Sn0.35Pb0.65I2.9Br0.1 perovskite on Cu3(HHTT)2 · Thin Film · Pb-Sn perovskite films on Cu3(HHTT)2 and NiOx HTLs compared under the same processing conditions.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu0.3BTC-100-8 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-100-14 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-100-20 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-100-3 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-100-5 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-100-8 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-120-14 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-120-20 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-120-3 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-120-5 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-120-8 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-80-14 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-80-20 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-80-3 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-80-5 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu1BTC-80-8 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu Kalpha radiation

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

1Cu3BTC-100-8 · Powder · D2 Phaser diffractometer; Cu Kalpha radiation, 30 kV, 10 mA, 2theta 5-50 deg, scan rate 3.0 deg/min; crystallite size calculated from the 11.6 deg (222) HKUST-1 peak by Scherrer equation.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2022 · Understanding Solvothermal Growth of Metal-Organic Framework Colloids for CO2Capture Applications

3Cu1BTC-100-8 · Powder · SI Section 7 copper-source variant; XRD pattern in Figure S13c with similar dc value reported as a range.

Diffraction StructurePowder

Powder X-ray diffraction

2022 · Wet-Adhesive On-Skin Sensors Based on Metal–Organic Frameworks for Wireless Monitoring of Metabolites in Sweat

Activated Ni3HHTP2 powder · Powder · Rikagu Miniflex 600 benchtop diffractometer, 2theta range 3-40 deg; Cu3HHTP2, Ni3HHTP2, and Ni3HITP2 compared.

Diffraction StructurePowder

Powder XRD and FT-IR

2021 · 2D/2D NiCo-MOFs/GO hybrid nanosheets for high-performance asymmetrical supercapacitor

NCMG-10 · Nanosheet · XRD collected from 5-60 deg 2theta at 5 deg min-1; FT-IR compared NCMG-10, NiCo-MOF and GO.

Diffraction StructureGrazing incidence

GIWAXS

2021 · A comparative study of honeycomb-like 2D π-conjugated metal-organic framework chemiresistors: conductivity and channels

Cu-HHTP NR thick-film chemiresistor · Electrode · Synchrotron GIWAXS collected at SPring-8 beamline 46XU, lambda = 1.0000 A, on thick-film chemiresistive gas sensors after activation and ageing.

Diffraction StructurePowder

PXRD

2021 · A comparative study of honeycomb-like 2D π-conjugated metal-organic framework chemiresistors: conductivity and channels

Cu-HITP powders · Powder · Powder X-ray diffraction recorded at SPring-8 beamline 02B2 (lambda = 0.79962 A) and/or Rigaku Smartlab with Cu Kalpha radiation (lambda = 1.54178 A).

Diffraction StructurePowder

Powder X-ray diffraction

2021 · A family of lanthanide metal-organic frameworks based on a redox-active tetrathiafulvalene-dicarboxylate ligand showing slow relaxation of magnetisation and electronic conductivity

2-Dy · Powder · PXRD patterns for 1-Ln and 2-Ln recorded with Cu target; simulated PXRD from single-crystal data.

Diffraction StructurePowder

Powder X-ray diffraction

2021 · A multifunctional n-doped cu–mofs (N–cu–mof) nanomaterial-driven electrochemical aptasensor for sensitive detection of deoxynivalenol

As-prepared N-Cu-MOF nanoparticles · Powder · XRD pattern collected on Bruker D8 Advance; HKUST-1-type peak assignment.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · A New Electrically Conducting Metal–Organic Framework Featuring U-Shaped cis-Dipyridyl Tetrathiafulvalene Ligands

I2-treated sine-MOF powder · Powder · PXRD of iodine-treated powder compared with pristine material; SI figure caption reports simulated, pristine, and iodine-treated traces.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · A New Electrically Conducting Metal–Organic Framework Featuring U-Shaped cis-Dipyridyl Tetrathiafulvalene Ligands

pristine sine-MOF evacuated powder · Powder · Experimental PXRD pattern compared with simulated pattern from SXRD after activation; SI reports Rigaku Ultima IV with Cu Kalpha radiation, lambda = 1.5406 A.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SXRD)

2021 · A New Electrically Conducting Metal–Organic Framework Featuring U-Shaped cis-Dipyridyl Tetrathiafulvalene Ligands

dark-red sine-MOF single crystals · Single Crystal · Bruker D8 Venture dual-source diffractometer with Cu and Mo radiation sources and CMOS detector; structure solved/refined with Bruker SHELXTL/SHELXT/SHELXL. Crystal structure report gives 100(2) K, Mo Kalpha wavelength 0.71073 A, and full refinement statistics.

Diffraction StructurePowder

powder X-ray diffraction (pXRD)

2021 · Cation-exchanged conductive Mn2DSBDC metal–organic frameworks: Synthesis, structure, and THz conductivity

Co@Mn2DSBDC powder · Powder · Powder packed into glass holder; Rigaku SmartLab; calculated reference from published single-crystal structure.

Diffraction StructurePowder

powder X-ray diffraction (pXRD)

2021 · Cation-exchanged conductive Mn2DSBDC metal–organic frameworks: Synthesis, structure, and THz conductivity

Cu@Mn2DSBDC powder · Powder · Powder packed into glass holder; Rigaku SmartLab; calculated reference from published single-crystal structure.

Diffraction StructurePowder

powder X-ray diffraction (pXRD)

2021 · Cation-exchanged conductive Mn2DSBDC metal–organic frameworks: Synthesis, structure, and THz conductivity

as-prepared Mn2DSBDC powder · Powder · Powder packed into glass holder; Rigaku SmartLab; calculated reference from published single-crystal structure.

Diffraction StructurePowder

powder X-ray diffraction (pXRD)

2021 · Cation-exchanged conductive Mn2DSBDC metal–organic frameworks: Synthesis, structure, and THz conductivity

Ni@Mn2DSBDC powder · Powder · Powder packed into glass holder; Rigaku SmartLab; calculated reference from published single-crystal structure.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

(TCNE)xCd2TTFTB series, samples 7-10 · Powder · PXRD of activated Cd2TTFTB and samples 7-10; comparison to activated host and Pawley profile fitting discussed.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

10: (TCNE)0.60@Cd2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

1: (TCNE)0.38@Zn2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

2: (TCNE)0.81@Zn2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

3: (TCNE)0.46@Zn2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

4: (TCNE)0.86@Zn2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

5: (TCNE)0.50@Zn2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

6: (TCNE)0.82@Zn2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

7: (TCNE)0.47@Cd2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

8: (TCNE)0.58@Cd2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

9: (TCNE)0.47@Cd2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

activated Cd2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowderRefinement

PXRD Pawley profile fit

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

activated Zn2TTFTB · Powder · Observed PXRD diffractogram fitted with calculated pattern; r_wp reported in figure legend.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

activated Zn2TTFTB · Powder · 2theta range 5-50 deg, step 0.01 deg; PANalytical Empyrean with Cu Kalpha1 radiation, 45 kV, 40 mA; samples in 0.7 mm borosilicate capillaries in capillary spinner.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2021 · Charge-Transfer-Induced Electrical Conductivity in a Tetrathiafulvalene-Based Metal-Organic Framework

(TCNE)xZn2TTFTB series, samples 1-6 · Powder · PXRD of activated Zn2TTFTB and samples 1-6; comparison to activated host and Pawley profile fitting discussed.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · Cluster-Bridging-Coordinated Bimetallic Metal−Organic Framework as High-Performance Anode Material for Lithium-Ion Storage

As-synthesised Co4-Ir MOF crystal/powder · Powder · Bruker D8 ADVANCE with Cu Kalpha radiation; HCl-amount optimisation shown from 10 to 60 uL in SI Figure S1.

Diffraction StructureUnspecified subtype

synchrotron X-ray diffraction

2021 · Conductive Metal-Organic Framework for High Energy Sodium-Ion Hybrid Capacitors

as-prepared Ni-MOF powder · Powder · As-prepared Ni-MOF compared with simulated AA-eclipsed stacking model.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD), Smartlab Rigaku

2021 · Conductive metal-organic frameworks promoting polysulfides transformation in lithium-sulfur batteries

Ni-HHTP@CP electrode · Electrode · XRD used to validate crystalline Ni-HHTP on carbon fibres and compare to carbon paper and solution-synthesised Ni-HHTP.

Diffraction StructurePowderRefinement

Pawley refinement of pXRD using MicroED CIF

2021 · Conductive Stimuli-Responsive Coordination Network Linked with Bismuth for Chemiresistive Gas Sensing

Bi(HHTP)-alpha MicroED crystal · Single Crystal · BIOVIA Materials Studio Pawley refinement of activated Bi(HHTP)

Diffraction StructurePowder

powder X-ray diffraction

2021 · Conductive Stimuli-Responsive Coordination Network Linked with Bismuth for Chemiresistive Gas Sensing

Bi(HHTP) powder from Procedure 2, 1:1 metal:ligand · Powder · Experimental pXRD pattern of Bi(HHTP); Bragg-law d-spacings assigned to hkl planes

Diffraction StructureUnspecified subtype

X-ray diffraction comparison to solvothermal HKUST-1

2021 · Conductive, Large-Area, and Continuous 7,7,8,8-Tetracyanoquinodimethane@HKUST-1 Thin Films Fabricated Using Solution Shearing

Solution-sheared HKUST-1 thin film, 4 cycles · Thin Film · Solution-sheared HKUST-1 compared against solvothermal HKUST-1 reference in q-space.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction / CIF

2021 · Conjugated crosslinks boost the conductivity and stability of a single crystalline metal-organic framework

CH3BPD-4F4TS single crystal · Single Crystal · Cu Kalpha radiation, 300 K, Bruker APEX-II CCD; SHELXL-2018 refinement

Diffraction StructurePowder

PXRD stability tests

2021 · Conjugated crosslinks boost the conductivity and stability of a single crystalline metal-organic framework

activated ZrBPD-4F4TS-Ox · Powder · ZrBPD-4F4TS-Ox after air storage, 1 M H2SO4 stirring, 0.01 M NaOH immersion, and N2/CO2 sorption tests

Diffraction StructurePowder

powder X-ray diffraction

2021 · Conjugated crosslinks boost the conductivity and stability of a single crystalline metal-organic framework

as-made ZrBPD-4F4TS colourless octahedron-shaped crystals · Single Crystal · as-synthesised ZrBPD-4F4TS compared with single-crystal calculated pattern

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2021 · Conjugated crosslinks boost the conductivity and stability of a single crystalline metal-organic framework

as-made ZrBPD-4F4TS colourless octahedron-shaped crystals · Single Crystal · Synchrotron MX2 beamline, lambda 0.70926 Angstrom, 100 K; unresolved/disordered framework model

Diffraction StructureUnspecified subtype

post-test XRD and SEM on comparator electrodes

2021 · Coordination environment dependent selectivity of single-site-Cu enriched crystalline porous catalysts in CO2 reduction to CH4

Cu-HHTP modified GDL-carbon paper electrode · Electrode · Fresh and tested Cu-HHTP, Cu-TTCOF and Cu-PPCOF modified GDL-carbon paper electrodes

Diffraction StructurePowder

PXRD and SEM of comparator frameworks

2021 · Coordination environment dependent selectivity of single-site-Cu enriched crystalline porous catalysts in CO2 reduction to CH4

as-prepared Cu-HHTP crystals/powder · Powder · As-prepared Cu-HHTP, Cu-TTCOF and Cu-PPCOF compared with simulated XRD patterns

Diffraction StructureUnspecified subtype

post-test XRD/Raman/SEM/XPS

2021 · Coordination environment dependent selectivity of single-site-Cu enriched crystalline porous catalysts in CO2 reduction to CH4

Cu-DBC modified GDL-carbon paper electrode · Electrode · Fresh and tested Cu-DBC modified GDL-carbon paper electrodes after electrolysis

Diffraction StructurePowder

PXRD; topological/structure assignment

2021 · Coordination environment dependent selectivity of single-site-Cu enriched crystalline porous catalysts in CO2 reduction to CH4

as-synthesised Cu-DBC powder/nanorods · Powder · Cu-DBC powder compared with simulated pattern; Cu-O4 coordination and dia topology assigned

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · Cu-Based Conductive MOF Grown in situ on Cu Foam as a Highly Selective and Stable Non-Enzymatic Glucose Sensor

Cu-MOF powder/sonicated particles · Powder · Cu-MOF powder collected from the reaction system compared with simulated pattern; Cu-MOF/CF PXRD was too weak.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD/XRD)

2021 · Effective visible-light CO2 photoreduction over (metallo)porphyrin-based metal–organic frameworks to achieve useful hydrocarbons

PCN-222(Fe) · Powder · PXRD patterns collected for PCN-222(Fe), PCN-222(Co), PCN-222(Ni), and PCN-222(Cu) on Siefert XRD 3003 PTS using Cu Kalpha1 radiation (k = 1.5406 A); Fe simulated pattern shown as reference.

Electrochemistry ApplicationPowder

Photocatalytic recycling experiment with post-reaction PXRD

2021 · Effective visible-light CO2 photoreduction over (metallo)porphyrin-based metal–organic frameworks to achieve useful hydrocarbons

PCN-222(Fe) · Powder · Six 10 h photocatalytic reaction runs over PCN-222(Fe); product-yield bars and before/after PXRD are shown in rendered SI Figures S11-S12.

Diffraction StructurePowderSingle crystal

single-crystal X-ray diffraction and PXRD

2021 · Effects of intervalence charge transfer interaction between π-stacked mixed valent tetrathiafulvalene ligands on the electrical conductivity of 3D metal-organic frameworks

Cs-MOF 4 · Powder · SXRD structures and PXRD phase-purity checks; Table 1 structural descriptors; SI crystallographic tables/CIF.

Diffraction StructurePowderSingle crystal

single-crystal X-ray diffraction and PXRD

2021 · Effects of intervalence charge transfer interaction between π-stacked mixed valent tetrathiafulvalene ligands on the electrical conductivity of 3D metal-organic frameworks

K-MOF 2 · Powder · SXRD structures and PXRD phase-purity checks; Table 1 structural descriptors; SI crystallographic tables/CIF.

Diffraction StructurePowderSingle crystal

single-crystal X-ray diffraction and PXRD

2021 · Effects of intervalence charge transfer interaction between π-stacked mixed valent tetrathiafulvalene ligands on the electrical conductivity of 3D metal-organic frameworks

Na-MOF 1-ox · Powder · SXRD structures and PXRD phase-purity checks; Table 1 structural descriptors; SI crystallographic tables/CIF.

Diffraction StructurePowderSingle crystal

single-crystal X-ray diffraction and PXRD

2021 · Effects of intervalence charge transfer interaction between π-stacked mixed valent tetrathiafulvalene ligands on the electrical conductivity of 3D metal-organic frameworks

Rb-MOF 3 · Powder · SXRD structures and PXRD phase-purity checks; Table 1 structural descriptors; SI crystallographic tables/CIF.

Diffraction StructureGrazing incidence

2D grazing-incidence wide-angle X-ray scattering (GIWAXS)

2021 · Electrically Conductive Metal–Organic Framework Thin Film-Based On-Chip Micro-Biosensor: A Platform to Unravel Surface Morphology-Dependent Biosensing

Pristine Cu-BHT thin film · Thin Film · Synchrotron GIWAXS used to determine crystallographic reflection centres, interlayer distance, and face-on orientation.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2021 · Electrically Conductive Metal–Organic Framework Thin Film-Based On-Chip Micro-Biosensor: A Platform to Unravel Surface Morphology-Dependent Biosensing

Pristine Cu-BHT thin film · Thin Film · PXRD pattern reproduced using eclipsed AA stacking model; Bruker D8 Advance with Cu Kalpha source in theta/2theta Bragg-Brentano geometry.

Diffraction StructureGrazing incidence

GIWAXS

2021 · Electrochemical Synthesis of Large Area Two-Dimensional Metal–Organic Framework Films on Copper Anodes

As-grown Cu3(HHTP)2 MOF film on single-crystal Cu(100) anode · Thin Film · Experimental GIWAXS compared with theoretical pattern for A-A stacked Cu3(HHTP)2.

Diffraction StructurePowder

powder X-ray diffraction

2021 · Electron-Conductive Metal-Organic Framework, Fe(dhbq)(dhbq = 2,5-Dihydroxy-1,4-benzoquinone): Coexistence of Microporosity and Solid-State Redox Activity

Anhydrous Fe(dhbq) powder · Powder · Air theta-2theta scan with Cu Kalpha radiation; compared hydrated, anhydrous and simulated patterns

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2021 · Electron-Conductive Metal-Organic Framework, Fe(dhbq)(dhbq = 2,5-Dihydroxy-1,4-benzoquinone): Coexistence of Microporosity and Solid-State Redox Activity

Fe(dhbq)(H2O)2 single crystals · Single Crystal · Mo Kalpha radiation; HyPix-6000 detector; structure solved for hydrated single crystal

Diffraction StructureUnspecified subtype

XRD

2021 · Electronic Doping of Metal-Organic Frameworks for High-Performance Flexible Micro-Supercapacitors

TCNQ@Cu3(BTC)2 thin film on Cu foil · Thin Film · XRD patterns of Cu3(BTC)2, TCNQ@Cu3(BTC)2, BQ@Cu3(BTC)2 and PMDI@Cu3(BTC)2 thin films on Cu foils; Rigaku D/max-2200/PC, Cu-Kalpha radiation (lambda 0.15418 nm), 40 kV, 5-30 degrees, 1 degree min^-1.

Diffraction StructureGrazing incidence

In situ GIWAXS during H2/He annealing

2021 · Emergence of Metallic Conductivity in Ordered One-Dimensional Coordination Polymer Thin Films upon Reductive Doping

H2/He-reduced Cu-DMD film on interdigitated electrode array · Electrode · Heating stage in stainless-steel chamber with Kapton windows; 170 deg C for 130 min to 2 h under 5% H2/He

Diffraction StructureGrazing incidence

GIWAXS substrate-orientation comparison

2021 · Emergence of Metallic Conductivity in Ordered One-Dimensional Coordination Polymer Thin Films upon Reductive Doping

Cu-DMD film on TiN-coated Si · Thin Film · Cu-DMD films deposited on TiN-coated and Pt-coated Si compared with native-oxide Si

Diffraction StructureGrazing incidence

XRD and grazing-incidence wide-angle X-ray scattering (GIWAXS)

2021 · Emergence of Metallic Conductivity in Ordered One-Dimensional Coordination Polymer Thin Films upon Reductive Doping

As-deposited Cu-DMD thin film on Si(100) with native oxide · Thin Film · Ex situ GIWAXS at NCD-SWEET beamline; 12.4 keV, incident angle 0.15 deg; XRD compared with calculated pattern

Diffraction StructurePowder

PXRD crystallinity comparison

2021 · Enhancing Electrical Conductivity of Semiconducting MOFs via Defect Healing

TATHB-treated Cu3(TATHB)2 · Pellet · Postsynthetic treatment of Cu3(TATHB)2 and Co3(HAB)2 analogues; Figure S11 cited.

Diffraction StructurePowder

powder X-ray diffraction

2021 · Enhancing One-Dimensional Charge Transport in Metal-organic Framework Hexagonal Nanorods for Electrocatalytic Oxygen Evolution

Fe-HXR hexagonal nanorods · Powder · PXRD pattern of Fe-HXR using Cu Kalpha radiation.

Diffraction StructurePowder

powder X-ray diffraction

2021 · Enhancing One-Dimensional Charge Transport in Metal-organic Framework Hexagonal Nanorods for Electrocatalytic Oxygen Evolution

NiFe-HXR hexagonal nanorods · Powder · PXRD pattern comparison of as-prepared Ni-HXR, Fe-HXR and NiFe-HXR against simulated pattern.

Diffraction StructurePowder

powder X-ray diffraction

2021 · Enhancing One-Dimensional Charge Transport in Metal-organic Framework Hexagonal Nanorods for Electrocatalytic Oxygen Evolution

NiFeOx derived oxide · Powder · PXRD pattern of derived NiFeOx.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2021 · Enhancing One-Dimensional Charge Transport in Metal-organic Framework Hexagonal Nanorods for Electrocatalytic Oxygen Evolution

Ni-HXR hexagonal nanorods · Powder · Crystal structure determination of Ni-HXR.

Diffraction StructurePowder

powder X-ray diffraction

2021 · Exploration of semiconducting properties of Zn(ii)- And Cd(ii)-based coordination polymers with dicarboxylate of a chair-type backbone

CP 1 colourless block crystals · Single Crystal · Room-temperature PXRD for as-synthesised CP 1 and CP 2 compared with simulated single-crystal patterns.

Diffraction StructurePowder

Powder X-ray diffraction

2021 · Fabrication of a halopyridine appended Co(II) based 1D coordination polymer for efficient charge transportation

As-synthesised bulk compound 1 · Powder · Bruker D8 Advance with Cu Kalpha radiation, 40 kV and 40 mA, 2theta range 5-50 degrees.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2021 · Fabrication of a halopyridine appended Co(II) based 1D coordination polymer for efficient charge transportation

Blocked shaped pink crystals of compound 1 · Single Crystal · Bruker SMART APEX II / APEX-II CCD diffractometer, Mo Kalpha radiation lambda = 0.71073 A; structure solved with SHELX/SHELXT and refined with SHELXL-2016/6.

Diffraction StructurePowder

powder X-ray diffraction

2021 · Facet Engineering in Ultrathin Two-Dimensional NiFe Metal-Organic Frameworks by Coordination Modulation for Enhanced Electrocatalytic Water Oxidation

NiFe-MOF NSs · Nanosheet · Bruker D8 Advance, Cu K alpha radiation, lambda = 1.5418 A

Diffraction StructurePowder

Powder X-ray diffraction

2021 · Facile design of highly effective Fe-modified bimetallic Fex–Ni1−x-MOFs catalysts with rodlike structures for low-temperature NO reduction by CO

Fex-Ni1-x-MOF powder catalyst series · Powder · Patterns compared with Ni-MOF and simulated Ni-MOF.

Diffraction StructurePowder

Powder X-ray diffraction

2021 · Facile synthesis of Ni-, Co-, Cu-metal organic frameworks electrocatalyst boosting for hydrogen evolution reaction

As-prepared Co-BTC crystals/powder · Powder · Rigaku Ultima IV using Cu K target, 40 kV, 40 mA, 5-90 degrees 2theta, 10 degrees min-1.

Diffraction StructurePowder

Powder X-ray diffraction

2021 · Facile synthesis of Ni-, Co-, Cu-metal organic frameworks electrocatalyst boosting for hydrogen evolution reaction

As-prepared Cu-BTC blue crystals/powder · Powder · Rigaku Ultima IV using Cu K target, 40 kV, 40 mA, 5-90 degrees 2theta, 10 degrees min-1.

Diffraction StructurePowder

Powder X-ray diffraction

2021 · Facile synthesis of Ni-, Co-, Cu-metal organic frameworks electrocatalyst boosting for hydrogen evolution reaction

As-prepared Ni-BTC precipitate/powder · Powder · Rigaku Ultima IV using Cu K target, 40 kV, 40 mA, 5-90 degrees 2theta, 10 degrees min-1.

Diffraction StructurePowder

powder XRD

2021 · Ferrocene-functionalized Ni(II)-based metal-organic framework as electrochemical sensing interface for ratiometric analysis of Cu2+, Pb2+ and Cd2+

Fc-NH2-Ni-MOF powder · Powder · Rigaku D-MAX 2500/PC XRD comparison of NH2-Ni-MOF and Fc-NH2-Ni-MOF.

Diffraction StructureTotal scattering / PDF

X-ray total scattering pair distribution function analysis.

2021 · From n- To p-Type Material: Effect of Metal Ion on Charge Transport in Metal-Organic Materials

a-Pt-HITP powder · Powder · Room-temperature Ag-source total scattering in 1.0 mm quartz capillaries; data corrected in GudrunX and processed with PDFGUI.

Diffraction StructurePowder

Powder X-ray diffraction.

2021 · From n- To p-Type Material: Effect of Metal Ion on Charge Transport in Metal-Organic Materials

a-Pd-HITP powder · Powder · SI PXRD comparison of Ni-HITP and amorphous Pd/Pt materials.

Diffraction StructurePowder

Hall-Williamson analysis of PXRD peak broadening

2021 · Growth and Characterisation of Copper Complex of 2, 4, 6-Trioxypyrimidine: A Novel Luminescent and Active Pharmaceutical Material in Metal Organic Framework

Crushed CuB powder · Powder · Beta cos(theta)/lambda plotted against sin(theta)/lambda to evaluate lattice strain from the slope.

Diffraction StructurePowder

PXRD and FTIR phase/functional-group checks

2021 · Heterometallic Actinide-Containing Photoresponsive Metal-Organic Frameworks: Dynamic and Static Tuning of Electronic Properties

Th5U-50% · Powder · PXRD patterns recorded on Rigaku Miniflex II at 1 deg/min, 30 kV, 15 mA; FTIR on Perkin-Elmer Spectrum 100.

Diffraction StructurePowder

PXRD

2021 · High-performance field-effect transistor glucose biosensors based on bimetallic Ni/Cu metal-organic frameworks

Ni/Cu-MOFs (7:1)-FET · Electrode · PXRD patterns of Ni-MOFs, Cu-MOFs and Ni/Cu-MOFs (7:1) films compared.

Diffraction StructureUnspecified subtype

Out-of-plane X-ray diffraction

2021 · Highly Selective and Sensitive Detection of Volatile Sulfur Compounds by Ionically Conductive Metal-Organic Frameworks

Cu-TCPP IC-MOF thin-film sensor on ITO interdigital electrodes · Electrode · Cu-TCPP IC-MOF thin film

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2021 · Immobilizing Redox-Active Tricycloquinazoline into a 2D Conductive Metal–Organic Framework for Lithium Storage

Pristine Cu-HHTQ black powder · Powder · Cu K-alpha irradiation; AA-stacked hexagonal model refined against experimental PXRD.

OtherPowder

TGA and post-soak PXRD

2021 · Immobilizing Redox-Active Tricycloquinazoline into a 2D Conductive Metal–Organic Framework for Lithium Storage

Pristine Cu-HHTQ black powder · Powder · TGA under N2; PXRD after 24 h immersion in 1 M NaOH and 1 M LiPF6.

Computational ModellingPowder

GSAS-II simulated PXRD structure model

2021 · Insights into the electric double-layer capacitance of two-dimensional electrically conductive metal-organic frameworks

simulated eclipsed Cu3(HHTP)2 structure · Model · Eclipsed primitive hexagonal model, space group P622.

Diffraction StructureGrazing incidence

GIWAXS

2021 · Interfacial Synthesis of Layer-Oriented 2D Conjugated Metal-Organic Framework Films toward Directional Charge Transport

Cu2[PcCu-O8] edge-on MOF film · Thin Film · XRD1 beamline at ELETTRA; Dectris Pilatus 2M; photon energy 12.398 keV; incidence angle 0.13 deg; exposure 180 s

Diffraction StructureUnspecified subtype

Out-of-plane and in-plane X-ray diffraction

2021 · Interplay of structural dynamics and electronic effects in an engineered assembly of pentacene in a metal-organic framework

Zn-Pn SURMOF-2 thin film · Thin Film · Bruker D8-Advance, Lynxeye detector, Cu Kalpha radiation lambda = 0.154018 nm

Diffraction StructurePowder

PXRD after humidity exposure

2021 · Lanthanide-Hypophosphite Frameworks with Guanidinium Guest Showing High Proton Conductivity

complex 1 colourless crystals / polycrystalline powder · Powder · sample kept in a constant humidity box at 97% RH for 24 h, then measured immediately

Diffraction StructurePowder

powder X-ray diffraction

2021 · Lanthanide-Hypophosphite Frameworks with Guanidinium Guest Showing High Proton Conductivity

complex 2 imidazolium Gd hypophosphite crystals · Powder · experimental and simulated PXRD patterns compared

Diffraction StructurePowder

powder X-ray diffraction

2021 · Lanthanide-Hypophosphite Frameworks with Guanidinium Guest Showing High Proton Conductivity

complex 3 pyrazole-derived Gd hypophosphite crystals · Powder · experimental and simulated PXRD patterns compared

Diffraction StructurePowder

powder X-ray diffraction

2021 · Lanthanide-Hypophosphite Frameworks with Guanidinium Guest Showing High Proton Conductivity

complex 4 triazolium Gd hypophosphite crystals · Powder · experimental and simulated PXRD patterns compared

Diffraction StructurePowder

Powder X-ray diffraction

2021 · Large Single Crystals of Two-Dimensional π-Conjugated Metal-Organic Frameworks via Biphasic Solution-Solid Growth

Ni-CAT-1 powder · Powder · PXRD of hydrothermally synthesized Ni-CAT-1 powder compared with simulated Co-CAT-1 and Cu-CAT-1 patterns.

Diffraction StructurePowder

PXRD

2021 · Large-area synthesis of nanoscopic catalyst-decorated conductive MOF film using microfluidic-based solution shearing

Pt@Cu3(HHTP)2 thin film, 100 uL/min Pt precursor · Thin Film · PXRD comparison of pristine Cu3(HHTP)2 and Pt@Cu3(HHTP)2 thin films

Diffraction StructureUnspecified subtype

XRD

2021 · Linker Defects Triggering Boosted Oxygen Reduction Activity of Co/Zn-ZIF Nanosheet Arrays for Rechargeable Zn–Air batteries

D-ZIF linker-deficient nanosheet array on Ni foam · Electrode · XRD spectra of ZIF, D-ZIF and simulated pattern.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2021 · Macrocycle-Based Metal-Organic Frameworks with NO2-Driven On/Off Switch of Conductivity

As-grown red MOF A single crystals/powder · Single Crystal · MOF A measured at 293 K using Mo Kalpha radiation; solved/refined with SHELXTL/SHELX-97/WINGX; solvent disorder treated with SQUEEZE.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2021 · Macrocycle-Based Metal-Organic Frameworks with NO2-Driven On/Off Switch of Conductivity

MOF A-100 heated/dehydrated crystals · Single Crystal · A-100 measured at 100 K using Mo Kalpha radiation; solved/refined with APEX III; solvent disorder treated with SQUEEZE.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2021 · Macrocycle-Based Metal-Organic Frameworks with NO2-Driven On/Off Switch of Conductivity

MOF A-NO2 yellow NO2-loaded crystal · Single Crystal · A-NO2 measured at 100 K using Mo Kalpha radiation; solved/refined with APEX III; solvent disorder treated with SQUEEZE.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2021 · Mimicking the Electron Transport Chain and Active Site of [FeFe] Hydrogenases in One Metal-Organic Framework: Factors That Influence Charge Transport

PCN-700_NDI_FeFe powder · Powder · Cu Kalpha, 3-55 degrees 2theta, 45 kV, 40 mA, 0.02 degree step; bulk powders dried under active vacuum at room temperature.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-ace · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1-ace.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-DCM · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1-DCM.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-DEE · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1-DEE.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-EtOH · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1-EtOH.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-MeOH · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1-MeOH.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-p-xylene · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1-p-xylene.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

Rh-metalated MnMOF-1 from DCM · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1.[Rh(CO)2][RhCl2(CO)2] prepared in DCM and acetone.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

Rh-metalated MnMOF-1 from p-xylene · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1.[Rh(CO)2][RhCl2(CO)2] prepared in p-xylene.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-THF · Single Crystal · Experimental dried PXRD pattern compared with simulated single-crystal pattern for MnMOF-1-THF.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-ace · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-CH3CN · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-DCM · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-DEE · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-des · Unknown · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-DMF/as · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-EtOH · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-MeOH · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-p-xylene · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

Rh-metalated MnMOF-1 from p-xylene · Single Crystal · Structure determination of Rh-metalated MnMOF-1 formed in p-xylene.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (SCXRD)

2021 · MOF matrix isolation: Cooperative conformational mobility enables reliable single crystal transformations

MnMOF-1-THF · Single Crystal · Unit-cell and structural comparison of MnMOF-1 solvatomorphs; new structures collected at 100 K where indicated.

Diffraction StructureGrazing incidence

Grazing-incidence X-ray diffraction, in-plane and out-of-plane

2021 · MOF Nanosheet Reconstructed Two-Dimensional Bionic Nanochannel for Protonic Field-Effect Transistors

Cu-TCPP thin film with 10 layer-by-layer deposition cycles · Thin Film · Cu-TCPP thin film with 10 deposition cycles; orientation compared with simulated pattern

Diffraction StructureUnspecified subtype

Water immersion stability test with XRD and SEM

2021 · MOF Nanosheet Reconstructed Two-Dimensional Bionic Nanochannel for Protonic Field-Effect Transistors

Cu-TCPP thin film with 10 layer-by-layer deposition cycles · Thin Film · Cu-TCPP thin film immersed in water for 40 days

Diffraction StructureGrazing incidence

2D GIWAXS

2021 · MOF-74(M) Films Obtained through Vapor-Assisted Conversion - Impact on Crystal Orientation and Optical Properties

MOF-74(Co) thin film on gold · Thin Film · MOF-74(Co) film on gold.

Diffraction StructureGrazing incidence

2D GIWAXS

2021 · MOF-74(M) Films Obtained through Vapor-Assisted Conversion - Impact on Crystal Orientation and Optical Properties

MOF-74(Mg) thin film on gold, oriented · Thin Film · Oriented MOF-74(Mg) film grown on gold after adding water and benzoic acid.

Diffraction StructureGrazing incidence

2D GIWAXS

2021 · MOF-74(M) Films Obtained through Vapor-Assisted Conversion - Impact on Crystal Orientation and Optical Properties

MOF-74(Mg) thin film on gold, nonoriented · Thin Film · MOF-74(Mg) film grown on gold with DMF/EtOH route.

Diffraction StructureGrazing incidence

2D GIWAXS

2021 · MOF-74(M) Films Obtained through Vapor-Assisted Conversion - Impact on Crystal Orientation and Optical Properties

MOF-74(Ni) thin film on glass · Thin Film · MOF-74(Ni) films on gold, glass and silicon; glass GIWAXS shown in Figure S29.

Diffraction StructureGrazing incidence

2D GIWAXS indexed with GIXSGUI

2021 · MOF-74(M) Films Obtained through Vapor-Assisted Conversion - Impact on Crystal Orientation and Optical Properties

MOF-74(Zn) thin film on gold · Thin Film · GIWAXS patterns of MOF-74(Zn) thin films on gold, glass and silicon; gold sample cited as highest degree of order.

Diffraction StructureUnspecified subtype

X-ray diffraction, out-of-plane and in-plane XRD

2021 · Oriented Growth of In-Oxo Chain Based Metal-Porphyrin Framework Thin Film for High-Sensitive Photodetector

In-TCPP SURMOF, 15 LPE cycles · Thin Film · Cu-Kalpha radiation; 2theta range 5-30 deg reported in SI instrumentation.

Microscopy MorphologyUnspecified subtype

Photo imaging, SEM, and XRD confirmation of patterned oriented Cu3(BTC)2

2021 · Oriented growth of semiconducting TCNQ@Cu3(BTC)2MOF on Cu(OH)2: crystallographic orientation and pattern formation toward semiconducting thin-film devices

Oriented Cu3(BTC)2 photolithographic patterns · Thin Film · Photolithographically patterned film on Si; SEM/photo images and XRD of oriented Cu3(BTC)2 patterns.

Diffraction StructureUnspecified subtype

Out-of-plane XRD, in-plane XRD, azimuthal phi scan, and in-plane RSM

2021 · Oriented growth of semiconducting TCNQ@Cu3(BTC)2MOF on Cu(OH)2: crystallographic orientation and pattern formation toward semiconducting thin-film devices

Three-dimensionally oriented Cu3(BTC)2 thin film · Thin Film · CuKalpha radiation; out-of-plane and in-plane geometries with incident angle parallel/perpendicular to nanobelt longitudinal direction; phi scan and RSM for orientation relationship.

Diffraction StructurePowder

powder X-ray diffraction

2021 · Photochromism and photomagnetism in three cyano-bridged 3d-4f heterobimetallic viologen frameworks

CoDy after UV-vis irradiation · Single Crystal · CoDy, CoEu and FeDy after 15 min irradiation compared with experimental and simulated patterns

Diffraction StructureSingle crystal

single-crystal X-ray diffraction after irradiation

2021 · Photochromism and photomagnetism in three cyano-bridged 3d-4f heterobimetallic viologen frameworks

CoEu after UV-vis irradiation / CoEu-a · Single Crystal · 293(2) K crystal data for CoEu-a after irradiation; monoclinic C2/c

Diffraction StructureGrazing incidence

GIXRD and SEM

2021 · Processable UiO-66 Metal-Organic Framework Fluid Gel and Electrical Conductivity of Its Nanofilm with Sub-100 nm Thickness

MOF-801 thin film · Thin Film · MOF-801 fluid gel/film characterised after applying UiO-66 spin-coating parameters.

Diffraction StructureGrazing incidence

GIXRD and SEM

2021 · Processable UiO-66 Metal-Organic Framework Fluid Gel and Electrical Conductivity of Its Nanofilm with Sub-100 nm Thickness

MOF-808 thin film · Thin Film · MOF-808 fluid gel/film characterised after applying UiO-66 spin-coating parameters.

Diffraction StructureGrazing incidence

GIXRD before and after chronoamperometry

2021 · Processable UiO-66 Metal-Organic Framework Fluid Gel and Electrical Conductivity of Its Nanofilm with Sub-100 nm Thickness

60 nm UiO-66 nanofilm · Thin Film · 60 nm UiO-66 thin film before device fabrication and after chronoamperometry measurement for 3600 s.

Diffraction StructureGrazing incidence

XRD/GIXRD using Bruker D8 ADVANCE, Cu Kalpha radiation

2021 · Processable UiO-66 Metal-Organic Framework Fluid Gel and Electrical Conductivity of Its Nanofilm with Sub-100 nm Thickness

UiO-66 nanofilm thickness series · Thin Film · Thin films and fluid gels measured by GIXRD with grazing incidence angle 0.10 degrees, 4 s step^-1, 0.01 degree step.

Microscopy MorphologyGrazing incidence

TEM and GIXRD particle-size/crystallite-size analysis

2021 · Processable UiO-66 Metal-Organic Framework Fluid Gel and Electrical Conductivity of Its Nanofilm with Sub-100 nm Thickness

UiO-66 nanofilm thickness series · Thin Film · Particle size of UiO-66 as a function of film thickness determined by TEM and GIXRD.

Diffraction StructurePowder

Powder X-ray diffraction and TEM

2021 · Promoting ethylene production over a wide potential window on Cu crystallites induced and stabilized via current shock and charge delocalization

As-synthesised Cu3(HHTP)2 powder · Powder · Structural and morphology checks of synthesised Cu3(HHTP)2 analogue.

Diffraction StructurePowder

Powder X-ray diffraction

2021 · Promoting ethylene production over a wide potential window on Cu crystallites induced and stabilized via current shock and charge delocalization

As-synthesised Cu3(HITP)2 powder · Powder · Crystalline phase of as-synthesised Cu3(HITP)2, Bruker D8 Advance, Cu-Kalpha radiation.

Diffraction StructureUnspecified subtype

Ex situ time-lapse XRD and TEM after chronoamperometric CO2RR

2021 · Promoting ethylene production over a wide potential window on Cu crystallites induced and stabilized via current shock and charge delocalization

Post-electrolytic KB@Cu3(HITP)2 after CO2RR · Electrode · -1.25 V versus RHE, CO2RR testing periods of 0.25, 1, 5 and 10 h; XRD catalyst on carbon paper.

Diffraction StructureUnspecified subtype

Ex situ XRD after electrochemical states

2021 · Quinone-Based Conducting Three-Dimensional Metal-Organic Framework as a Cathode Material for Lithium-Ion Batteries

(NBu4)2Fe2(DHBQ)3/Super P/PVDF lithium-ion cathode electrode · Electrode · XRD patterns of pristine, discharged 1.5 V and charged 3.5 V electrodes.

Diffraction StructurePowderRefinement

Powder XRD with Rietveld refinement

2021 · Quinone-Based Conducting Three-Dimensional Metal-Organic Framework as a Cathode Material for Lithium-Ion Batteries

as-prepared (NBu4)2Fe2(DHBQ)3 powder/solid · Powder · Powder XRD pattern compared with simulated data; Rietveld refinement used to assign cubic I-43d structure and unit cell.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction, Bruker D8/APEX-II CCD with Cu Kalpha radiation; SHELXT/SHELXL refinement with SQUEEZE

2021 · Redox Ladder of Ni3 Complexes with Closed-Shell, Mono-, and Diradical Triphenylene Units: Molecular Models for Conductive 2D MOFs

complex 2 dark blue needle-shaped crystals · Single Crystal · Needle crystal measured at 100(2) K; Cu Kalpha wavelength 1.54178 A; solvent electron density removed by SQUEEZE.

Diffraction StructureGrazing incidence

GIWAXS at SSRL beamline 11-3, 12.7 keV, incidence angle 0.18 deg

2021 · Semiconducting to Metallic Electronic Landscapes in Defects-Controlled 2D π-d Conjugated Coordination Polymer Thin Films

Cu-BHT thin film from solid-vapor interfacial CVD polymerization growth · Thin Film · 2D GIWAXS on Cu-BHT grown atop glass substrate; azimuthal integration used for mosaicity factor

Diffraction StructureGrazing incidence

GIWAXS at SSRL beamline 11-3, 12.7 keV, incidence angle 0.18 deg

2021 · Semiconducting to Metallic Electronic Landscapes in Defects-Controlled 2D π-d Conjugated Coordination Polymer Thin Films

Cu-BHT thin film from vapor-vapor interfacial CVD polymerization growth · Thin Film · 2D GIWAXS on Cu-BHT grown atop glass substrate; azimuthal integration used for mosaicity factor

Diffraction StructureGrazing incidence

GIXRD line scan

2021 · Semiconducting to Metallic Electronic Landscapes in Defects-Controlled 2D π-d Conjugated Coordination Polymer Thin Films

Cu-BHT thin film from solid-vapor interfacial CVD polymerization growth · Thin Film · SI line scan in q space and 2theta for S-V CVD Cu-BHT

Diffraction StructureGrazing incidence

GIXRD line scan

2021 · Semiconducting to Metallic Electronic Landscapes in Defects-Controlled 2D π-d Conjugated Coordination Polymer Thin Films

Cu-BHT thin film from vapor-vapor interfacial CVD polymerization growth · Thin Film · SI line scan in q space and 2theta for V-V CVD Cu-BHT

Diffraction StructurePowder

X-ray powder diffraction, D/MAX Ultima III

2021 · Si nanoparticles confined within a conductive 2D porous Cu-based metal–organic framework (Cu3(HITP)2) as potential anodes for high-capacity Li-ion batteries

Si@Cu3(HITP)2-5 · Powder · XRD patterns for pure Si and Si@Cu3(HITP)2-5/10/15 composites.

Diffraction StructurePowder

X-ray powder diffraction, D/MAX Ultima III

2021 · Si nanoparticles confined within a conductive 2D porous Cu-based metal–organic framework (Cu3(HITP)2) as potential anodes for high-capacity Li-ion batteries

pure Cu-MOF (Cu3(HITP)2) · Powder · Phase identification and purity of pure Cu3(HITP)2.

Diffraction StructurePowder

PXRD, Cu sealed tube, 2theta 5-30 deg

2021 · Simultaneous defect passivation and hole mobility enhancement of perovskite solar cells by incorporating anionic metal-organic framework into hole transport materials

synthesised FJU-17 powder · Powder · Powder XRD after synthesis and solvent exchange; compared with simulated FJU-17 pattern in SI.

Diffraction StructureUnspecified subtype

XRD of aged perovskite films

2021 · Simultaneous defect passivation and hole mobility enhancement of perovskite solar cells by incorporating anionic metal-organic framework into hole transport materials

perovskite film with HTM-FJU-17 after ageing · Thin Film · Perovskite films with pristine HTM or HTM-FJU-17 aged at 85 degC; comparison of perovskite and PbI2 diffraction peaks.

Diffraction StructurePowder

PXRD with Cu-Kalpha radiation

2021 · Soft Electrochemical Actuators with a Two-Dimensional Conductive Metal-Organic Framework Nanowire Array

core-shell Ni-CAT NWAs/CNF electrode · Electrode · PXRD patterns of pristine CNF, Ni-CAT powder and Ni-CAT NWAs/CNF; 2theta 3-50 deg, 0.02 deg step, room temperature in air.

Diffraction StructurePowder

Powder XRD, TGA, XPS

2021 · Solar-driven ionic power generation: Via a film of nanocellulose @ conductive metal-organic framework

Freestanding CCM film · Thin Film · XRD for Ni-HITP and cellulose reflections; TGA under air; Ni 2p3/2 XPS comparing CCM, pure Ni-HITP, and CC-Ni.

Diffraction StructureUnspecified subtype

Ex situ XRD and SEM before/after charging and after cycling

2021 · Spindle-like Ni3(HITP)2 MOFs: Synthesis and Li+ storage mechanism

Ni3(HITP)2 electrode on copper foil · Electrode · Film electrodes on Cu foil before and after charge were characterised by XRD; SEM before charge and after 10 charge/discharge cycles.

Diffraction StructureUnspecified subtype

X-ray diffraction

2021 · Stabilization of NASICON-Type Electrolyte against Li Anode via an Ionic Conductive MOF-Incorporated Adhesive Interlayer

sintered LAGP pellet · Pellet · LAGP powder and sintered pellet compared with standard NASICON PDF#80-1922

Diffraction StructureUnspecified subtype

X-ray diffraction

2021 · Stabilization of NASICON-Type Electrolyte against Li Anode via an Ionic Conductive MOF-Incorporated Adhesive Interlayer

ZCPL-LAGP electrolyte · Pellet · ZCPL and ZCPL-LAGP patterns

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2021 · Structural and electronic modulation of conductive MOFs for efficient oxygen evolution reaction electrocatalysis

NiPc-NiFex powder series · Powder · PANalytical Empyrean, Cu Kalpha radiation, 40 kV and 40 mA; compared with simulated pattern.

Diffraction StructurePowder

PXRD

2021 · Structural and electronic modulation of conductive MOFs for efficient oxygen evolution reaction electrocatalysis

NiPc-Fe powder control · Powder · PXRD pattern of NiPc-Fe control.

Diffraction StructurePowder

PXRD

2021 · Structural and electronic modulation of conductive MOFs for efficient oxygen evolution reaction electrocatalysis

NiPc-Ni powder control · Powder · Experimental and simulated PXRD pattern of NiPc-Ni MOF.

Microscopy MorphologyUnspecified subtype

SEM, TEM, XRD and FTIR

2021 · Sulfur vacancies enriched Nickel-Cobalt sulfides hollow spheres with high performance for All-Solid-State hybrid supercapacitor

Ni-Co CP spheres · Powder · Precursor sphere morphology and coordination assessed in main text using SI figures.

Microscopy MorphologyUnspecified subtype

SEM/TEM and XRD during sulfidation evolution

2021 · Sulfur vacancies enriched Nickel-Cobalt sulfides hollow spheres with high performance for All-Solid-State hybrid supercapacitor

NiCo2S4-X HSs intermediates (X = 0.5, 1, 2, 4 h) · Powder · NiCo2S4 hollow sphere evolution at 160 C for 0.5, 1, 2, 4 and 6 h.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Ka radiation

2021 · Sulfur vacancies enriched Nickel-Cobalt sulfides hollow spheres with high performance for All-Solid-State hybrid supercapacitor

r-NiCo2S4-6 HSs · Powder · Phase comparison of NiCo2S4-6 HSs and r-NiCo2S4-6 HSs.

Diffraction StructurePowder

powder X-ray diffraction (XRD, 9 kW/SmartLab)

2021 · Synthesis of a novel double-ligand nickel conductive metal–organic framework material and its electrochemical characterization for supercapacitors

Ni-MOF green powder · Powder · Experimental PXRD compared with simulated XRD spectrum for Ni-MOF.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2021 · Synthesis of a novel double-ligand nickel conductive metal–organic framework material and its electrochemical characterization for supercapacitors

Ni-MOF green powder · Powder · Crystal structure solution of Product 1 / Ni-MOF.

Diffraction StructurePowder

Powder X-ray diffraction

2021 · Synthesis, identification and application of metal organic framework for removal of industrial cationic dyes

White ZIF-7 crystals · Powder · PXRD pattern compared with literature/JCPDS card; Debye-Scherrer equation used for crystallite size.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2021 · The Different Roles of Cobalt and Manganese in Metal-Organic Frameworks for Supercapacitors

Co3(HITP)2 bulk powder · Powder · PXRD recorded on Rigaku RINT Ultima III; Pawley refinement in Reflex/MS Modeling 8.0 according to SI.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley refinement

2021 · The Different Roles of Cobalt and Manganese in Metal-Organic Frameworks for Supercapacitors

Mn3(HITP)2 bulk powder · Powder · PXRD recorded on Rigaku RINT Ultima III; Pawley refinement in Reflex/MS Modeling 8.0 according to SI.

Diffraction StructurePowder

powder X-ray diffraction

2021 · The Origins of Ion Conductivity in MOF-Ionic Liquids Hybrid Solid Electrolytes

MIL-121/Li · Pellet · XRD patterns of activated pristine MIL-121 and ion-exchanged MIL-121/Li at room temperature using Cu Kalpha radiation.

Diffraction StructurePowderRefinement

Powder X-ray diffraction; Pawley refinement

2021 · Two-dimensional conductive metal-organic frameworks with dual metal sites toward the electrochemical oxygen evolution reaction

NiPc-Ni powder/nanosheets · Nanosheet · PANalytical Empyrean, Cu Kalpha radiation 1.540598 Angstrom, 40 kV, 40 mA; structure compared with DFT-optimised eclipsed AA stacking.

Diffraction StructurePowder

PXRD of iodine-doped Cu3(HHTN)2

2021 · Two-dimensional d-π conjugated metal-organic framework based on hexahydroxytrinaphthylene

iodine-doped Cu3(HHTN)2 powder · Powder · Experimental PXRD pattern compared with pristine Cu3(HHTN)2 and elemental I2.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha radiation

2021 · Two-dimensional d-π conjugated metal-organic framework based on hexahydroxytrinaphthylene

as-synthesised Cu3(HHTN)2 dark brown powder · Powder · PXRD used to confirm Cu3(HHTN)2 formation and compare experimental pattern with simulated slipped-parallel and staggered structures.

Diffraction StructurePowder

powder X-ray diffraction stability comparisons

2021 · Ultra-Stable Metal-Organic Framework with Concurrent High Proton Conductivity and Fluorescence Sensing for Nitrobenzene

yellow block single crystals of compound 1 · Single Crystal · PXRD after heating at 100, 150, 200, 250 and 300 °C for 24 h in air; after water immersion for over one month; after organic-solvent soaking for one month; after pH 3-11 for 2 weeks; after pH 2 and pH 12 for several hours; after proton-conducting measurement

Diffraction StructureGrazing incidence

synchrotron grazing-incidence XRD and out-of-plane XRD

2021 · Uniaxially Oriented Electrically Conductive Metal-Organic Framework Nanosheets Assembled at Air/Liquid Interfaces

HITP-Ni-NS on Si at pi = 10 mN m-1 · Thin Film · HITP-Ni-NS on Si; lambda = 1.24 Angstrom; in-plane incident angle alpha = 0.16 degrees; SPring-8 at room temperature under helium.

Diffraction StructureUnspecified subtype

synchrotron in-plane and out-of-plane XRD

2021 · Uniaxially Oriented Electrically Conductive Metal-Organic Framework Nanosheets Assembled at Air/Liquid Interfaces

HATP-water-NS control · Nanosheet · HATP-water-NS on silicon substrate with 45 deposition cycles at pi = 10 mN m-1.

Diffraction StructureGrazing incidence

GIXRD with Cu Kalpha X-ray source plus IR comparison

2021 · Uniaxially Oriented Electrically Conductive Metal-Organic Framework Nanosheets Assembled at Air/Liquid Interfaces

HITP-Ni-NS deposited immediately at pi = 0 mN m-1 · Thin Film · HITP-Ni-NS deposited at pi = 0 mN m-1; SmartLab Rigaku at room temperature; alpha = 0.19 degrees.

Diffraction StructurePowder

XRPD comparison with simulated patterns

2021 · Vapor-Induced Superionic Conduction of Magnesium Ions in a Metal-Organic Framework

Mg-MOF-74 parent powder · Powder · Prepared Mg-MOF-74 and Mg(TFSI)2.8H2O were compared with simulated XRPD patterns.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; structure solution/refinement

2021 · Wells-Dawson Arsenotungstate Porous Derivatives for Electrochemical Supercapacitor Electrodes and Electrocatalytically Active Materials

Compound 1 dark-blue crystals · Single Crystal · Crystal data and structural refinement listed in main Table 1; SI states Bruker SMART APEX II with W Kalpha radiation and SHELXTL-2014 refinement.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; structure solution/refinement

2021 · Wells-Dawson Arsenotungstate Porous Derivatives for Electrochemical Supercapacitor Electrodes and Electrocatalytically Active Materials

Compound 2 dark-blue crystals · Single Crystal · Crystal data and structural refinement listed in main Table 1; SI states Bruker SMART APEX II with W Kalpha radiation and SHELXTL-2014 refinement.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2021 · Wells-Dawson Arsenotungstate Porous Derivatives for Electrochemical Supercapacitor Electrodes and Electrocatalytically Active Materials

{As2W18O62} control dark crystals · Single Crystal · Control compound crystallographic refinement in SI Table S1.

Diffraction StructurePowder

Powder X-ray diffraction (XRPD)

2021 · Wells-Dawson Arsenotungstate Porous Derivatives for Electrochemical Supercapacitor Electrodes and Electrocatalytically Active Materials

Compound 1 dark-blue crystals · Single Crystal · Powder samples of compounds 1 and 2 compared with simulated curves; Cu Kalpha radiation, 5-50 degrees two-theta.

Diffraction StructurePowder

Powder X-ray diffraction, Rigaku D/max-2200, Cu-Kalpha

2020 · A conductive anionic Co-MOF cage with zeolite framework for supercapacitors

Co-MOF on Ni foam · Electrode · lambda = 1.54184 A, 35 kV, 30 mA, scan rate 0.03 degrees/s (2theta), room temperature; compared with crystal sample and simulated curves.

Diffraction StructurePowder

powder X-ray diffraction (pXRD)

2020 · A conductive metal-organic framework photoanode

Zn2TTFTB-FTO · Thin Film · pXRD of Zn2TTFTB films on FTO, TiO2 and ZrO2 compared with calculated pattern from reported single-crystal structure.

SpectroscopyPowder

IR spectroscopy and PXRD before/after NH3 exposure

2020 · A Dual-Ligand Porous Coordination Polymer Chemiresistor with Modulated Conductivity and Porosity

Cu3(HHTP)(THQ) nanowire thick-film gas sensor · Thin Film · IR spectra and PXRD patterns measured before and after exposure to NH3; O2 pressure PXRD comparison in SI.

Diffraction StructureGrazing incidence

GIXRD

2020 · A highly oriented conductive MOF thin film-based Schottky diode for self-powered light and gas detection

Cu3(C18H6(NH)6)2-20 nm thin film on functionalised n-Si · Thin Film · Out-of-plane and in-plane GIXRD; X-ray wavelength 1.0000 A, in-plane incident angle 0.12, exposure time 20 s.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction on Bruker-AXS SMART APEX II with graphite monochromated Mo-Kalpha radiation; SHELXT/SHELXL refinement

2020 · Application of two Cu(II)-azido based 1D coordination polymers in optoelectronic device: Structural characterization and experimental studies

complex 1 reddish coloured needle crystals · Single Crystal · Crystal positioned 60 mm from CCD; 360 frames; 5 s counting time; non-H atoms anisotropic; absorption correction by SADABS.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction on Bruker-AXS SMART APEX II with graphite monochromated Mo-Kalpha radiation; SHELXT/SHELXL refinement

2020 · Application of two Cu(II)-azido based 1D coordination polymers in optoelectronic device: Structural characterization and experimental studies

complex 2 crystalline product · Single Crystal · Crystal positioned 60 mm from CCD; 360 frames; 5 s counting time; disorder in N(33)/C(34) refined over two positions; BASF twin refinement.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha radiation

2020 · Biporous Cd(II) Coordination Polymer via in Situ Disulfide Bond Formation: Self-Healing and Application to Photosensitive Optoelectronic Device

Bulk/crude material of compound 1 · Powder · 2theta range 5-50 deg; as-synthesised and after irradiation compared with simulated pattern.

Diffraction StructurePowderWide / small angle scattering

PXRD and SAXS stability checks

2020 · Colloidal crystal engineering with metal–organic framework nanoparticles and DNA

Ag+-stabilized PCN-222 2D superlattice photocatalyst · Powder · PXRD/SAXS after thermal treatment at 150 deg C for 48 h, MeOH reflux 24 h, 70 deg C water 24 h, pH 2 buffer 24 h, and after 5 catalytic cycles.

Diffraction StructurePowder

PXRD

2020 · Colloidal crystal engineering with metal–organic framework nanoparticles and DNA

DNA-PEG5k-functionalised PCN-222 PAEs · Powder · Rigaku Smartlab PXRD of PCN-222 nanorods before and after DNA functionalisation.

Diffraction StructurePowder

PXRD

2020 · Colloidal crystal engineering with metal–organic framework nanoparticles and DNA

DNA-PEG5k-functionalised UiO-66 PAEs · Powder · Rigaku Smartlab PXRD with Ni-filtered Cu-Kalpha radiation, lambda = 1.5418 A, 45 kV and 160 mA.

Diffraction StructureWide / small angle scattering

SAXS

2020 · Colloidal crystal engineering with metal–organic framework nanoparticles and DNA

37 nm UiO-66 / 40 nm Au CsCl superlattice · Powder · SAXS of binary UiO-66/Au DNA-linked superlattices.

Diffraction StructureWide / small angle scattering

SAXS and cryo-STEM

2020 · Colloidal crystal engineering with metal–organic framework nanoparticles and DNA

PCN-222 2D tetragonal nanorod superlattice · Powder · PCN-222 nanorod superlattices characterised by SAXS and cryo-STEM; DNA linker length varied for tetragonal lattice spacing.

Diffraction StructureWide / small angle scattering

SAXS

2020 · Colloidal crystal engineering with metal–organic framework nanoparticles and DNA

UiO-66 fcc MOF superlattice · Powder · SAXS at DND-CAT APS, X-ray wavelength 1.24 A (10 keV); 2D data radially averaged and indexed with Matlab.

Diffraction StructureUnspecified subtype

Out-of-plane X-ray diffraction

2020 · Conductive Metal-Organic Framework Thin Film Hybrids by Electropolymerization of Monosubstituted Acetylenes

BPA@Cu(BDC)-SURMOF-2 after electropolymerisation · Electrode · D8-Advance Bruker AXS diffractometer, Cu K-alpha radiation, theta-theta geometry, position sensitive detector, variable divergence slit.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2020 · Conductive Metal-Organic Frameworks for Amperometric Sensing of Paracetamol

As-synthesised NiCu-CAT nanocrystals · Powder · Rigaku D/max-2550 diffractometer with Cu Kalpha radiation, lambda = 1.5418 Angstrom; compared with simulated NiCu-CAT pattern.

Diffraction StructurePowder

Powder X-ray diffraction after pretreatment/storage

2020 · Conductive Metal-Organic Frameworks for Amperometric Sensing of Paracetamol

NiCu-CAT/GCE after air storage for 7-30 days · Electrode · XRD pattern after pretreatment during 30 days; rendered Supplementary Figure 6 compares traces labelled 7 d and 30 d.

Diffraction StructureUnspecified subtype

Supplementary XRD pattern comparison

2020 · Conductive metal–Organic frameworks endow high-efficient oxygen evolution of La0·6Sr0·4Co0·8Fe0·2O3 perovskite oxide nanofibers

LSCF@Ni3(HITP)2-2 · Powder · Rendered SI Fig. S1 compares as-prepared LSCF, bare Ni3(HITP)2 and LSCF@Ni3(HITP)2-1/-2/-3/-4.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2020 · Conductive metal–Organic frameworks endow high-efficient oxygen evolution of La0·6Sr0·4Co0·8Fe0·2O3 perovskite oxide nanofibers

LSCF NFs · Powder · Philips X'pert Pro, Cu Kalpha lambda 1.5406 A, 40 kV, 40 mA, room temperature; LSCF, Ni3(HITP)2 and LSCF@Ni3(HITP)2-2 compared.

Electrochemistry ApplicationUnspecified subtype

Durability by repeated CV, chronoamperometry, post-test XRD/TEM/SEM

2020 · Conductive Metal–Organic Frameworks with Extra Metallic Sites as an Efficient Electrocatalyst for the Hydrogen Evolution Reaction

Ni3(Ni3.HAHATN)2 modified rotating disk electrode · Electrode · HER stability in 0.1 M KOH; repeated CV for 1000 cycles; chronoamperometry at 10 and 50 mA cm-2 for 10 h.

Diffraction StructurePowder

X-ray powder diffraction

2020 · Conductive MOFs as bifunctional oxygen electrocatalysts for all-solid-state Zn-air batteries

[Ni5.7Ru0.3(HHTP)3(H2O)x]n powder · Powder · XRD comparison of Ni-HHTP and Ru-doped samples using Cu Kalpha radiation.

Diffraction StructurePowderRefinement

PXRD with Pawley refinement

2020 · Conjugated Copper–Catecholate Framework Electrodes for Efficient Energy Storage

As-synthesised Cu-DBC powder · Powder · RIGAKU SMARTLAB9KW, Cu target tube and K beta filter; Pawley refinement against PXRD.

Diffraction StructurePowder

PXRD and SEM after solvent immersion

2020 · Conjugated Copper–Catecholate Framework Electrodes for Efficient Energy Storage

As-synthesised Cu-DBC powder · Powder · Cu-DBC immersed in nine solvents for seven days; SEM after water immersion.

Diffraction StructurePowder

Powder X-ray diffraction, Bruker D8 Discover, Cu-Kalpha radiation

2020 · Construction of a Succinate-Bridged Cd(II)-Based Two-Dimensional Coordination Polymer for Efficient Optoelectronic Device Fabrication and Explosive Sensing Application

As-synthesised bulk compound 1 powder/crystals · Powder · Finely ground as-synthesised sample at room temperature compared with simulated single-crystal pattern.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction on Bruker SMART APEX II, Mo Kalpha radiation; SHELX-97 refinement

2020 · Construction of a Succinate-Bridged Cd(II)-Based Two-Dimensional Coordination Polymer for Efficient Optoelectronic Device Fabrication and Explosive Sensing Application

Yellow needle-shaped single crystals of compound 1 · Single Crystal · Crystal dimensions 0.112 x 0.101 x 0.097 mm; room temperature 296(2) K; hkl range -18<h<17, -19<k<19, -14<l<14.

Diffraction StructurePowderRefinement

High-resolution synchrotron PXRD; Pawley refinement

2020 · Continuous Electrical Conductivity Variation in M3(Hexaiminotriphenylene)2(M = Co, Ni, Cu) MOF Alloys

Co3(HITP)2 powder/pellet · Powder · Collected at 100 K, APS 11-BM, Debye-Scherrer geometry; best fit orthorhombic Cmcm.

Diffraction StructurePowderRefinement

High-resolution synchrotron PXRD; Pawley refinement

2020 · Continuous Electrical Conductivity Variation in M3(Hexaiminotriphenylene)2(M = Co, Ni, Cu) MOF Alloys

Cu3(HITP)2 powder/pellet · Powder · Collected at 100 K, APS 11-BM, Debye-Scherrer geometry; best fit orthorhombic Cmcm.

Diffraction StructurePowderRefinement

High-resolution synchrotron PXRD; Pawley refinement

2020 · Continuous Electrical Conductivity Variation in M3(Hexaiminotriphenylene)2(M = Co, Ni, Cu) MOF Alloys

Ni3(HITP)2 powder/pellet · Powder · Collected at 100 K, APS 11-BM, Debye-Scherrer geometry; best fit orthorhombic Cmcm.

Diffraction StructurePowder

Powder X-ray diffraction

2020 · Controlling the Thermoelectric Properties of Organometallic Coordination Polymers via Ligand Design

purified Ni-ett powder · Powder · Powder XRD patterns for the three OMCPs; Figure S14 in the SI and main text report diffraction positions and d-spacings.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2020 · Direct Evidence of Photoinduced Charge Transport Mechanism in 2D Conductive Metal Organic Frameworks

Cu-THQ powder · Powder · Rigaku Miniflex II XRD diffractometer with Cu Kalpha radiation; compared Cu-THQ and Cu/Zn-THQ patterns with kagome lattice and prior Cu-THQ patterns.

Diffraction StructurePowderRefinement

Laboratory PXRD with Pawley refinement

2020 · Efficient and tunable one-dimensional charge transport in layered lanthanide metal–organic frameworks

HoHHTP powder · Powder · Cu Kalpha laboratory PXRD; for unit-cell estimation, material mixed with LaB6 and refined by simultaneous Pawley/Rietveld methods.

Diffraction StructurePowderRefinement

Laboratory PXRD with Pawley refinement

2020 · Efficient and tunable one-dimensional charge transport in layered lanthanide metal–organic frameworks

LaHHTP powder · Powder · Cu Kalpha laboratory PXRD; for unit-cell estimation, material mixed with LaB6 and refined by simultaneous Pawley/Rietveld methods.

Diffraction StructurePowderRefinement

Laboratory PXRD with Pawley refinement

2020 · Efficient and tunable one-dimensional charge transport in layered lanthanide metal–organic frameworks

NdHHTP powder · Powder · Cu Kalpha laboratory PXRD; for unit-cell estimation, material mixed with LaB6 and refined by simultaneous Pawley/Rietveld methods.

Diffraction StructurePowderRefinement

Synchrotron PXRD Rietveld refinement

2020 · Efficient and tunable one-dimensional charge transport in layered lanthanide metal–organic frameworks

NdHHTP powder · Powder · Activated sample loaded into quartz capillary in N2 glovebox; high-resolution data at APS 17-BM, lambda = 0.45212 A; measured under vacuum at room temperature.

Diffraction StructurePowderRefinement

Laboratory PXRD with Pawley refinement

2020 · Efficient and tunable one-dimensional charge transport in layered lanthanide metal–organic frameworks

YbHHTP powder · Powder · Cu Kalpha laboratory PXRD; for unit-cell estimation, material mixed with LaB6 and refined by simultaneous Pawley/Rietveld methods.

Diffraction StructurePowderRefinement

Synchrotron PXRD Rietveld refinement

2020 · Efficient and tunable one-dimensional charge transport in layered lanthanide metal–organic frameworks

YbHHTP powder · Powder · Activated sample loaded into quartz capillary in N2 glovebox; high-resolution data at APS 17-BM, lambda = 0.45212 A; measured under vacuum at room temperature.

Diffraction StructurePowder

PXRD after air exposure

2020 · Electrical Conductivity in a Porous, Cubic Rare-Earth Catecholate

Y6HOTP2 powder exposed to air · Powder · PXRD patterns of as-made Y6HOTP2 and same powder kept under air for two weeks or one month.

Diffraction StructurePowder

PXRD after conductivity measurement

2020 · Electrical Conductivity in a Porous, Cubic Rare-Earth Catecholate

Activated Y6HOTP2 pressed pellets, batch 1 · Pellet · Pressed pellet compared with original activated powder after electrical conductivity measurements.

Diffraction StructurePowder

powder X-ray diffraction

2020 · Electrically Conductive 3D Metal-Organic Framework Featuring π-Acidic Hexaazatriphenylene Hexacarbonitrile Ligands with Anion-πInteraction and Efficient Charge-Transport Capabilities

Evacuated [Ag2(HATHCN)(CF3SO3)2]n bulk material · Powder · PXRD patterns of simulated, as-synthesised, evacuated, and post-I-V MOF samples; Rigaku Ultima IV Cu Kalpha source per SI.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (Mo Kalpha)

2020 · Electrically Conductive 3D Metal-Organic Framework Featuring π-Acidic Hexaazatriphenylene Hexacarbonitrile Ligands with Anion-πInteraction and Efficient Charge-Transport Capabilities

Free HATHCN ligand powder/crystals · Powder · SXRD of HATHCN ligand crystals at 293(2) K; trigonal R -3 c; offset pi-stacks.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction (Mo Kalpha)

2020 · Electrically Conductive 3D Metal-Organic Framework Featuring π-Acidic Hexaazatriphenylene Hexacarbonitrile Ligands with Anion-πInteraction and Efficient Charge-Transport Capabilities

As-synthesised orange [Ag2(HATHCN)(CF3SO3)2]n crystals · Single Crystal · SXRD at 165(2) K; structure refined as tetragonal I -4 2 d; disordered MeNO2 solvent included in crystallographic model.

Diffraction StructureGrazing incidence

GIXRD

2020 · Electrochemical deposition and thermoelectric characterisation of a semiconducting 2-D metal-organic framework thin film

Cu3(HHTP)2@Au/SiO2 as-deposited film · Thin Film · As-deposited Cu3(HHTP)2 on Au/SiO2 and PMMA-transferred film

Diffraction StructureGrazing incidence

GIXRD; Rigaku Smartlab, CuKalpha radiation

2020 · Electrochemical deposition and thermoelectric characterisation of a semiconducting 2-D metal-organic framework thin film

Cu3(HHTP)2@FTO film, 0.435 V · Thin Film · Electrodeposited Cu3(HHTP)2 on FTO at different applied potentials

Diffraction StructurePowder

powder XRD

2020 · Electrochemical deposition of Cu metal-organic framework films for the dual analysis of pathogens

Cu-MOF/GCE electrode · Electrode · Synthesised Cu-MOF pattern compared with simulated Cu-MOF pattern.

Diffraction StructurePowder

powder X-ray diffraction

2020 · Electrochemical immunoassay for the carcinoembryonic antigen based on Au NPs modified zeolitic imidazolate framework and ordered mesoporous carbon

Au@ZIF-8 nanoparticles · Powder · XRD patterns of Au@ZIF-8, ZIF-8, and simulated ZIF-8.

Diffraction StructurePowder

FTIR, PXRD, TEM/HRTEM, SAED, AFM, SEM, Tyndall effect

2020 · Electrochemical Transformation of Metal Organic Framework into Ultrathin Metal Hydroxide-(oxy)hydroxide Nanosheets for Alkaline Water Oxidation

CF-2 · Electrode · Structural and morphological characterisation of CF-2, with CF-1/CF-3/CF-4 comparisons in SI

Diffraction StructurePowder

PXRD

2020 · Electrochemical Transformation of Metal Organic Framework into Ultrathin Metal Hydroxide-(oxy)hydroxide Nanosheets for Alkaline Water Oxidation

CoFe-PBA@CC · Electrode · Cu Kalpha radiation; compared to CoHC@CC and JCPDF-01-077-1161

Diffraction StructurePowder

FTIR, PXRD, SEM, TEM, AFM, Tyndall effect, ICP-AES

2020 · Electrochemical Transformation of Metal Organic Framework into Ultrathin Metal Hydroxide-(oxy)hydroxide Nanosheets for Alkaline Water Oxidation

NF-2 · Electrode · Characterisation of NF-2 nanosheets derived from NiFe-PBA@CC

Diffraction StructurePowder

PXRD, ATR-FTIR, SEM, TEM/HRTEM, EDX

2020 · Electrochemical Transformation of Metal Organic Framework into Ultrathin Metal Hydroxide-(oxy)hydroxide Nanosheets for Alkaline Water Oxidation

NiFe-PBA@CC · Electrode · Characterisation of NiFe-PBA@CC precursor

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2020 · Emergence of electrical conductivity in a flexible coordination polymer by using chemical reduction

black solid 2 from 1 · Powder · PXRD of reduced 2 from 1 and reduced 2 from 1d compared with 1 and 1d.

Diffraction StructurePowder

Powder X-ray diffraction, Cu Kalpha

2020 · Encapsulating metal organic framework into hollow mesoporous carbon sphere as efficient oxygen bifunctional electrocatalyst

ZIF@HMCS-m series · Powder · PXRD patterns of HMCS, ZIF-67 and ZIF@HMCS-m samples

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD, PANalytical)

2020 · Enhanced bioelectrochemical performance caused by porous metal-organic framework MIL-53(Fe) as the catalyst in microbial fuel cells

MIL-53(Fe) yellow powder · Powder · Powder XRD used to assign MIL-53(Fe) crystal planes.

Diffraction StructurePowder

Powder X-ray diffraction

2020 · Enhancement in electrical conductivity of a porous indium based metal-organic framework upon I2 uptake: Combined experimental and theoretical investigations

I2@1 - about 10 days · Powder · PXRD compared I2@1 (0.1 M iodine - 10 days), experimental 1 and simulated 1.

Diffraction StructureUnspecified subtype

X-ray diffraction

2020 · Heteroatom-doped 3D porous carbon architectures for highly stable aqueous zinc metal batteries and non-aqueous lithium metal batteries

NOCA@CF · Electrode · XRD patterns of ZIF-8@CF, NOCA@CF, and NOCA layer.

Diffraction StructurePowderRefinement

Synchrotron PXRD with Pawley fit

2020 · High Thermopower in a Zn-Based 3D Semiconductive Metal-Organic Framework

Zn-HAB_NEt3 / TEA 9 equiv as-synthesised powder · Powder · PXRD at beamline 17-BM, Advanced Photon Source; wavelength 0.45260 angstrom; Pawley fit in TOPAS using space group I4122.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2020 · High-performance non-enzymatic glucose detection: Using a conductive Ni-MOF as an electrocatalyst

Pristine conductive Ni-MOF black powder · Powder · Rigaku D/MAX 2550 with Cu Kalpha radiation (lambda = 1.5418 A); pristine conductive Ni-MOF and after long-term tests.

Diffraction StructurePowder

PXRD after solvent/chemical soaking

2020 · Highly Conductive Two-Dimensional Metal-Organic Frameworks for Resilient Lithium Storage with Superb Rate Capability

as-prepared Cu-BHT powder · Powder · 10 mg sample ultrasonically dispersed into 3 mL solvent for 10 min, stood for 25 h, washed with H2O and acetone

Diffraction StructurePowderRefinement

PXRD with structure simulation/Rietveld refinement

2020 · Highly Conductive Two-Dimensional Metal-Organic Frameworks for Resilient Lithium Storage with Superb Rate Capability

as-prepared Cu-BHT powder · Powder · as-prepared 2D Cu-BHT powder; simulated and experimental patterns compared

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2020 · Highly Dispersed MoO2Nanoparticles Confined in N-Doped Porous Carbon Nanosheets for Efficient Hydrogen Evolution in Alkaline Media

Mo-MOF/NF · Electrode · Rigaku D/Max 2550 with Cu Kalpha radiation, lambda = 1.5418 A.

Diffraction StructureUnspecified subtype

XRD

2020 · Highly Dispersed MoO2Nanoparticles Confined in N-Doped Porous Carbon Nanosheets for Efficient Hydrogen Evolution in Alkaline Media

MoO2 NPs@N-C NSs peeled from NF · Nanosheet · MoO2 NPs@N-C NSs peeled from NF by ultrasonication and remeasured to avoid intense NF peaks.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2020 · Highly Selective CO2 Electroreduction to CH4 by In Situ Generated Cu2O Single-Type Sites on a Conductive MOF: Stabilizing Key Intermediates with Hydrogen Bonding

Cu2O@CuHHTP, -1.2 V 30 min · Electrode · Cu K alpha radiation, lambda = 0.154 nm

Diffraction StructurePowder

Temperature-resolved powder XRD, Panalytical Empyrean

2020 · Humidity-mediated anisotropic proton conductivity through the 1d channels of co-mof-74

Co-MOF-74 powder sample · Powder · 93% relative humidity; CHC plus+ chamber; Cu radiation; 20-60 C in 5 C steps after 15 min isothermal steps; 5-50 degrees 2theta.

Diffraction StructurePowder

powder X-ray diffraction

2020 · Interdigitated conducting tetrathiafulvalene-based coordination networks

Network 4 iodine-treated powder/crystals for EPR, PXRD, and EDX · Powder · PXRD patterns of 4 and 5 before and after treatment with 0.05 M I2 in CHCl3, compared with simulated single-crystal data.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Interdigitated conducting tetrathiafulvalene-based coordination networks

Network 4 as-synthesised single crystal · Single Crystal · Network 4; Bruker SMART CCD, Mo-Kalpha, 173 K; SHELXS/SHELXL refinement.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Interdigitated conducting tetrathiafulvalene-based coordination networks

Network 5 as-synthesised single crystal · Single Crystal · Network 5; Bruker SMART CCD, Mo-Kalpha, 173 K; SHELXS/SHELXL refinement.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Interdigitated conducting tetrathiafulvalene-based coordination networks

Ligand 1 in CH2Cl2 solution for cyclic voltammetry · Model · Molecular crystal structure; Bruker SMART CCD, Mo-Kalpha, 173 K; SHELXS/SHELXL refinement.

Diffraction StructurePowder

Powder X-ray diffraction (Cu Kalpha, lambda = 1.5406 A)

2020 · Ionic liquid supported nickel-based metal-organic framework for electrochemical sensing of hydrogen peroxide and electrocatalytic oxidation of methanol

as-synthesised Ni-MOF crystals · Powder · Rigaku MiniFlex 600; scan speed 2 deg min^-1; step size 0.02 deg in 2theta; compared with simulated single-crystal data.

Diffraction StructurePowder

powder X-ray diffraction

2020 · Isoreticular Linker Substitution in Conductive Metal–Organic Frameworks with Through-Space Transport Pathways

Cd activated bulk microcrystalline powder · Powder · as-synthesised and activated Cd compared to simulated SCXRD pattern

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Isoreticular Linker Substitution in Conductive Metal–Organic Frameworks with Through-Space Transport Pathways

Cd diffraction-quality/single-crystal device crystals · Single Crystal · 100 K; Cu Kalpha, SHELXT/SHELXL refinement; SQUEEZE for pore solvent

Diffraction StructurePowder

powder X-ray diffraction

2020 · Isoreticular Linker Substitution in Conductive Metal–Organic Frameworks with Through-Space Transport Pathways

Mn activated bulk microcrystalline powder · Powder · as-synthesised and activated Mn compared to simulated SCXRD pattern

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Isoreticular Linker Substitution in Conductive Metal–Organic Frameworks with Through-Space Transport Pathways

Mn diffraction-quality/single-crystal device crystals · Single Crystal · 100 K; Mo Kalpha, SHELXT/SHELXL refinement; SQUEEZE for pore solvent

Diffraction StructurePowder

powder X-ray diffraction

2020 · Isoreticular Linker Substitution in Conductive Metal–Organic Frameworks with Through-Space Transport Pathways

Zn activated bulk microcrystalline powder · Powder · as-synthesised and activated Zn compared to simulated SCXRD pattern

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Isoreticular Linker Substitution in Conductive Metal–Organic Frameworks with Through-Space Transport Pathways

Zn diffraction-quality single crystals · Single Crystal · 100 K; Cu Kalpha, SHELXT/SHELXL refinement; SQUEEZE for pore solvent

Diffraction StructurePowder

Powder X-ray diffraction; Bruker D8, Cu Kalpha radiation

2020 · M-008: A stable and reusable metalorganic framework with high crystallinity applied in the photocatalytic hydrogen evolution and the degradation of methyl orange

M-008a · Powder · 10-70 degrees 2theta, 0.05 degree step size, 0.05 s per step; Scherrer crystallite size from preferential diffraction peak.

Diffraction StructurePowder

Powder X-ray diffraction; Bruker D8, Cu Kalpha radiation

2020 · M-008: A stable and reusable metalorganic framework with high crystallinity applied in the photocatalytic hydrogen evolution and the degradation of methyl orange

M-008b · Powder · 10-70 degrees 2theta, 0.05 degree step size, 0.05 s per step; Scherrer crystallite size from preferential diffraction peak.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Oxford Diffraction Xcalibur Nova R, Cu-Kalpha radiation

2020 · Magnetic and electrical behaviors of the homo-and heterometallic 1d and 3d coordination polymers based on the partial decomposition of the [cr(C2o4)3]3− building block

Compound 1 yellow crystals / polycrystalline pressed pellet · Pellet · single crystal; data collected at 293(2) K; structure solved with SHELXS97 and refined with SHELXL-2017

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Oxford Diffraction Xcalibur Nova R, Cu-Kalpha radiation

2020 · Magnetic and electrical behaviors of the homo-and heterometallic 1d and 3d coordination polymers based on the partial decomposition of the [cr(C2o4)3]3− building block

Compound 2 green prismatic crystals / polycrystalline pressed pellet · Pellet · single crystal; data collected at 100(2) K; structure solved with SHELXS97 and refined with SHELXL-2017

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Oxford Diffraction Xcalibur Nova R, Cu-Kalpha radiation

2020 · Magnetic and electrical behaviors of the homo-and heterometallic 1d and 3d coordination polymers based on the partial decomposition of the [cr(C2o4)3]3− building block

Compound 3 dark green prismatic crystals / polycrystalline pressed pellet · Pellet · single crystal; data collected at 293(2) K; Friedel pairs measured to establish absolute structure

Diffraction StructureGrazing incidenceWide / small angle scattering

GI-WAXS

2020 · Metal-organic framework nanosheets for enhanced performance of organic photovoltaic cells

P3HT-Zn2(ZnTCPP) 1:0.5 blend film · Thin Film · Xeuss 2.0, MetalJet liquid gallium X-ray source, 9.24 keV, 400 um beam, Pilatus3R 1M detector, near critical angle under vacuum.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD/XRPD)

2020 · Metal-organic framework nanosheets for enhanced performance of organic photovoltaic cells

bulk Zn2(ZnTCPP)(DMF) MOF · Powder · Cu Kalpha source, lambda=1.5418 Angstrom, 40 kV and 40 mA; bulk MOF compared with exfoliated MONs and literature patterns.

Diffraction StructurePowder

TGA/DSC with temperature-dependent PXRD

2020 · Mixed Anionic and Cationic Redox Chemistry in a Tetrathiomolybdate Amorphous Coordination Framework

dehydrated <Na2MoS4> powder · Powder · TGA under N2 at 10 C min-1; PXRD survey of dehydration after annealing at different temperatures.

Diffraction StructureUnspecified subtype

in situ electrochemical XRD

2020 · Mixed Anionic and Cationic Redox Chemistry in a Tetrathiomolybdate Amorphous Coordination Framework

<Na2MoS4> in situ XRD composite electrode cell · Electrode · Transmission-mode XRD during electrochemical cycling; reference patterns for Li2S, Na2S, and S8 aligned to in situ data.

Diffraction StructurePowder

powder X-ray diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP1 orange solid from method A · Powder · PXRD from 2theta = 5-40 deg, step size 0.02 deg, 20 s per step, CuKalpha radiation; experimental and calculated patterns compared

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP1 orange/red single crystals · Single Crystal · Bruker Kappa Apex II diffractometer, MoKalpha radiation; room-temperature structure

Diffraction StructurePowder

variable-temperature X-ray powder diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP1 orange solid from method A · Powder · VT-XRPD using Anton Paar TTK450 stage; CP1 heated to 150 C / 375 K according to text

Diffraction StructurePowder

powder X-ray diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP2 orange/red crystals · Single Crystal · PXRD from 2theta = 5-40 deg, step size 0.02 deg, 20 s per step, CuKalpha radiation; experimental and calculated patterns compared

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP2 orange/red crystals · Single Crystal · Oxford Xcalibur S diffractometer, MoKalpha radiation; CP2 data collected at 293 K and 100 K

Diffraction StructurePowder

variable-temperature X-ray powder diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP2 orange/red crystals · Single Crystal · VT-XRPD using Anton Paar TTK450 stage

Diffraction StructurePowder

powder X-ray diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP3 yellow crystals from method A · Single Crystal · PXRD from 2theta = 5-40 deg, step size 0.02 deg, 20 s per step, CuKalpha radiation; experimental and calculated patterns compared

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP3 yellow crystals from method A · Single Crystal · Oxford Xcalibur S diffractometer, MoKalpha radiation; room-temperature structure

Diffraction StructurePowder

variable-temperature X-ray powder diffraction

2020 · Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: Synthesis, and structural, optical and electrical characterization

CP3 yellow crystals from method A · Single Crystal · VT-XRPD using Anton Paar TTK450 stage

Diffraction StructurePowder

Powder X-ray diffraction (PXRD/XRD), Cu Kalpha

2020 · Multimetal Incorporation into 2D Conductive Metal-Organic Framework Nanowires Enabling Excellent Electrocatalytic Oxidation of Benzylamine to Benzonitrile

NiCoFe-CAT nanowire powder · Powder · Series of Ni-CAT, NiCo-CAT, NiFe-CAT, and NiCoFe-CAT compared with simulated Ni-CAT pattern.

Diffraction StructurePowder

PXRD

2020 · Multiscale optimization of Li-ion diffusion in solid lithium metal batteries: Via ion conductive metal-organic frameworks

Flexible LCMOF-1/PVDF-HFP/Li-IL SE · Thin Film · PXRD of LCMOF-1, PVDF-HFP/Li-IL, LCMOF-1/PVDF-HFP/Li-IL and before/after cycling.

Diffraction StructurePowder

PXRD/XRD

2020 · Multiscale optimization of Li-ion diffusion in solid lithium metal batteries: Via ion conductive metal-organic frameworks

UiO-66-2CO2H-NDP · Powder · Cu Kalpha radiation; 2theta range 5-50 deg; comparison with simulated UiO-66-2CO2H pattern.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha source

2020 · Nanorods of a novel highly conductive 2D metal-organic framework based on perthiolated coronene for thermoelectric conversion

Ni-PTC nanorod dark powder · Powder · D/max 2500; 2theta step 0.023 deg from 5.0 to 50.0 deg, 30 s per step; sample well-ground before PXRD.

Diffraction StructurePowderRefinement

Synchrotron powder X-ray diffraction with Rietveld refinement

2020 · Paramagnetic Conducting Metal–Organic Frameworks with Three-Dimensional Structure

Fe-THBQ black powder · Powder · Beamline BL14B1 at SSRF; microcrystalline sample in flame-sealed 0.5 mm boron-rich glass capillary; room temperature; 2-52 deg, 0.003 deg step, wavelength 0.690026 A.

Diffraction StructurePowder

Synchrotron powder X-ray diffraction indexing

2020 · Paramagnetic Conducting Metal–Organic Frameworks with Three-Dimensional Structure

Mn-THBQ powder · Powder · Beamline BL14B1 at SSRF; powder in flame-sealed capillary; room temperature; wavelength 0.690026 A.

Diffraction StructurePowder

powder X-ray diffraction

2020 · Particle size dependence of proton conduction in a cationic lanthanum phosphonate MOF

as-synthesised PCMOF21-AcO bulk powder · Powder · PXRD of simulated, as-synthesised, dehydrated, post-impedance and aqueous-condition samples; Bruker D8 Advanced or Rigaku Miniflex II Cu-source instruments at ambient temperature.

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction / CIF refinement

2020 · Particle size dependence of proton conduction in a cationic lanthanum phosphonate MOF

PCMOF21-AcO single crystals · Single Crystal · Single crystal collected at 100 K; Mo Kalpha radiation, lambda 0.71073 A; Bruker APEX-II CCD; SHELXT/SHELXL/Olex2 refinement.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Kalpha radiation

2020 · Pillared nickel-based metal-organic frameworks as electrode material with high electrochemical performance

(Zn/Ni)2(bdc)2P powder · Powder · X'Pert Pro diffractometer; lambda = 1.5406 A; scan step 0.02 deg in 2theta; comparison to simulated single-crystal patterns.

Diffraction StructurePowder

Powder X-ray diffraction pattern for Zn2(bdc)2P

2020 · Pillared nickel-based metal-organic frameworks as electrode material with high electrochemical performance

Zn2(bdc)2P powder · Powder · Experimental Zn2(bdc)2P XRD compared with simulated pattern in Supplementary Fig. S1.

Diffraction StructurePowder

powder X-ray diffraction

2020 · Proton-Conductive 3D LnIII Metal–Organic Frameworks for Formic Acid Impedance Sensing

ZZU-1 crystalline sample · Single Crystal · PXRD after water, boiling water and pH treatment for ZZU-1 and ZZU-2

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; SHELXT/SHELXL refinement

2020 · Semiconducting Supramolecular Organic Frameworks Assembled from a Near-Infrared Fluorescent Macrocyclic Probe and Fullerenes

single crystals of pristine receptor 2 · Single Crystal · Agilent Technologies SuperNova Dual Source diffractometer, micro-focused Cu Kalpha radiation, 100 K.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; SHELXT/SHELXL refinement; PLATON SQUEEZE

2020 · Semiconducting Supramolecular Organic Frameworks Assembled from a Near-Infrared Fluorescent Macrocyclic Probe and Fullerenes

single crystals of (2*C60)n SOF · Single Crystal · Agilent Technologies SuperNova Dual Source diffractometer, micro-focus Cu Kalpha radiation, 100 K; C60 refined as rigid groups.

Diffraction StructurePowder

PXRD before/after electrode fabrication and bulk electrolysis

2020 · Single-Site, Single-Metal-Atom, Heterogeneous Electrocatalyst: Metal–Organic-Framework Supported Molybdenum Sulfide for Redox Mediator-Assisted Hydrogen Evolution Reaction

MoSx-SIM-NDC-SALI/FTO electrode · Electrode · Rigaku ATX-G, 2theta = 0.05 degree step, 2 degrees/min over 2-20 degrees at 50 kV and 240 mA; film washed before after-catalysis PXRD

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2020 · Single-Site, Single-Metal-Atom, Heterogeneous Electrocatalyst: Metal–Organic-Framework Supported Molybdenum Sulfide for Redox Mediator-Assisted Hydrogen Evolution Reaction

MoSx-SIM-NDC-SALI powder/single crystals · Single Crystal · Bruker KAPPA APEX II, CuKalpha lambda = 1.54178 A, 200 K; SHELXT/SHELXL/Olex2 refinement with PLATON SQUEEZE

Diffraction StructurePowder

Control-atmosphere SEM and PXRD

2020 · Solid-solid interface growth of conductive metal-organic framework nanowire arrays and their supercapacitor application

Cu3(HHTP)2 nanowire arrays in situ grown on Cu foil · Electrode · Products from Ar, Ar/D-H2O, Ar/O2 and Ar/O-H2O atmospheres compared by SEM and PXRD.

Diffraction StructurePowder

PXRD

2020 · Solid-solid interface growth of conductive metal-organic framework nanowire arrays and their supercapacitor application

Cu3(HHTP)2 nanowire arrays in situ grown on Cu foil · Electrode · PANalytical Empyrean diffractometer with Cu radiation, 3 < 2theta < 30 degrees, step size 0.026 degrees, room temperature.

Electrochemistry ApplicationPowder

Three-electrode GCD cycling stability and post-cycling PXRD

2020 · Solid-solid interface growth of conductive metal-organic framework nanowire arrays and their supercapacitor application

Cu3(HHTP)2 nanowire arrays in situ grown on Cu foil · Electrode · 5000 GCD cycles between -0.6 V and -0.02 V at 10 A g-1 in 1 M KCl; PXRD before/after cycling.

Diffraction StructurePowder

PXRD

2020 · Solid-solid interface growth of conductive metal-organic framework nanowire arrays and their supercapacitor application

Fe3(HHB)2 grown on Fe foil · Thin Film · Experimental and simulated PXRD patterns compared for Fe3(HHB)2.

Diffraction StructurePowder

powder X-ray diffraction; Bruker D8 ADVANCE

2020 · Stabilization of cyclic water tetramers and dimers in the crystal host of 2D coordination networks: electrical conductivity and dielectric studies

compound 1 yellow needle-shaped crystals, as synthesised · Single Crystal · room-temperature PXRD for powder samples of compounds 1 and 2, including as-synthesised, dehydrated and rehydrated states

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction; Bruker SMART APEX II; SHELXT-2014/5 refinement

2020 · Stabilization of cyclic water tetramers and dimers in the crystal host of 2D coordination networks: electrical conductivity and dielectric studies

compound 1 yellow needle-shaped crystals, as synthesised · Single Crystal · suitable light-yellow single crystal; main/SI report Mo Kalpha lambda 0.71073 A; CIF for compound 1 lists Cu Kalpha lambda 1.54178 A

Diffraction StructureUnspecified subtype

XRD

2020 · Synthesis and characterization of Fe3O4-supported metal–organic framework MIL-101(Fe) for a highly selective and sensitive hydrogen peroxide electrochemical sensor

MIL-101(Fe)@Fe3O4 nanoparticles · Powder · Rigaku Ultima-IV diffractometer

Diffraction StructureUnspecified subtype

Synchrotron XRD

2020 · Synthesis of a copper 1,3,5-triamino-2,4,6-benzenetriol metal-organic framework

Iodine-doped Cu3(TABTO)2-Ar powder · Powder · Synchrotron XRD of pristine and iodine-doped Cu3(TABTO)2-Ar; X-ray energy 18.981 keV, wavelength 0.6532 Angstrom.

Diffraction StructurePowder

Powder XRD

2020 · Synthesis of a copper 1,3,5-triamino-2,4,6-benzenetriol metal-organic framework

Cu3(TABTO)2-Air-1 powder · Powder · XRD comparison of Cu3(TABTO)2-Air-1 and Cu3(TABTO)2-Air-2.

Diffraction StructurePowder

Powder XRD

2020 · Synthesis of a copper 1,3,5-triamino-2,4,6-benzenetriol metal-organic framework

Cu3(TABTO)2-Ar powder · Powder · As-obtained Cu3(TABTO)2-Ar powder compared with simulated AA' and SP stacking patterns.

Diffraction StructurePowder

PXRD before and after electrical measurements

2020 · The Advent of Electrically Conducting Double-Helical Metal-Organic Frameworks Featuring Butterfly-Shaped Electron-Rich π-Extended Tetrathiafulvalene Ligands

1a pressed MOF pellet · Pellet · PXRD of pelletized 1 and 1a before and after electrical measurements; SI Figure S4 reports good agreement

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2020 · The Advent of Electrically Conducting Double-Helical Metal-Organic Frameworks Featuring Butterfly-Shaped Electron-Rich π-Extended Tetrathiafulvalene Ligands

1, activated pristine dhMOF · Powder · Experimental PXRD of activated pristine dhMOF compared with simulated SXRD pattern

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2020 · The Advent of Electrically Conducting Double-Helical Metal-Organic Frameworks Featuring Butterfly-Shaped Electron-Rich π-Extended Tetrathiafulvalene Ligands

1a, iodine-treated washed evacuated dhMOF · Powder · PXRD of iodine-treated, hexane-washed and evacuated 1a compared with pristine 1

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SCXRD/SXRD)

2020 · The Advent of Electrically Conducting Double-Helical Metal-Organic Frameworks Featuring Butterfly-Shaped Electron-Rich π-Extended Tetrathiafulvalene Ligands

1, activated pristine dhMOF · Powder · Structure determination of orange plate-like pristine dhMOF crystals; solvent molecules omitted in figure for clarity; SI/CIF: Bruker D8 Venture/Quest, Mo Kalpha 0.71073 A, 133(2) K, P-1 triclinic refinement

Diffraction StructurePowder

Powder X-ray diffraction with Cu Ka radiation

2020 · Three-dimensional Co/Ni bimetallic organic frameworks for high-efficient catalytic ozonation of atrazine: Mechanism, effect parameters, and degradation pathways analysis

Co-MOF red crystals · Powder · D8-Advance diffractometer; 40 kV, 40 mA; 2theta range 5-90 deg.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Ka radiation

2020 · Three-dimensional Co/Ni bimetallic organic frameworks for high-efficient catalytic ozonation of atrazine: Mechanism, effect parameters, and degradation pathways analysis

Co/Ni-MOF brown powder · Powder · D8-Advance diffractometer; 40 kV, 40 mA; 2theta range 5-90 deg.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Ka radiation

2020 · Three-dimensional Co/Ni bimetallic organic frameworks for high-efficient catalytic ozonation of atrazine: Mechanism, effect parameters, and degradation pathways analysis

Ni-MOF green crystals · Powder · D8-Advance diffractometer; 40 kV, 40 mA; 2theta range 5-90 deg.

Diffraction StructurePowder

PXRD/XRD with Cu Kalpha radiation

2020 · Trimetallic conductive metal-organic frameworks as precatalysts for the oxygen evolution reaction with enhanced activity

FeCo0.6Ni0.4-CAT powder/electrode, Fe/(Co+Ni) about 0.32 · Electrode · Patterns compared across CoxNi1-x-CAT and FeCoxNi1-x-CAT samples.

Diffraction StructurePowder

Powder X-ray diffraction, Bruker D8 Advance, Cu radiation.

2020 · Tuning Electrical- and Photo-Conductivity by Cation Exchange within a Redox-Active Tetrathiafulvalene-Based Metal–Organic Framework

TTF@1 crystals · Single Crystal · Room-temperature PXRD; patterns compared with simulated single-crystal data and solvent/pH stability patterns.

Diffraction StructurePowder

Powder XRD

2020 · Tuning Lewis acidity of MIL-88B-Fe with mix-valence coordinatively unsaturated iron centers on ultrathin Ti3C2 nanosheets for efficient photo-Fenton reaction

CUCs-MIL-88B-Fe powder · Powder · 2 theta scan after activation.

Diffraction StructurePowder

Powder XRD

2020 · Tuning Lewis acidity of MIL-88B-Fe with mix-valence coordinatively unsaturated iron centers on ultrathin Ti3C2 nanosheets for efficient photo-Fenton reaction

CUCs-MIL-88B-Fe/Ti3C2 powder · Powder · 2 theta scan of composite.

Diffraction StructurePowder

Powder XRD

2020 · Tuning Lewis acidity of MIL-88B-Fe with mix-valence coordinatively unsaturated iron centers on ultrathin Ti3C2 nanosheets for efficient photo-Fenton reaction

MIL-88B-Fe powder · Powder · 2 theta scan using EMPYREAN diffractometer.

Diffraction StructurePowder

PXRD after 0.1 M KOH chemical stability treatment

2020 · Two-Dimensional Conductive Ni-HAB as a Catalyst for the Electrochemical Oxygen Reduction Reaction

Cu-HAB powder · Powder · As-synthesised sample suspended in 0.1 M KOH for 24 h at room temperature, washed, dried, degassed and characterised by PXRD.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2020 · Two-Dimensional Conductive Ni-HAB as a Catalyst for the Electrochemical Oxygen Reduction Reaction

Ni-HAB-H high-crystallinity powder · Powder · Cu-sealed tube, lambda = 1.54 A, capillary, 50 kV and 1 mA; compared before and after 0.1 M KOH buffer treatment.

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2020 · Two-Dimensional Conductive Ni-HAB as a Catalyst for the Electrochemical Oxygen Reduction Reaction

Ni-HAB-L low-crystallinity powder · Powder · Cu-sealed tube, lambda = 1.54 A, capillary, 50 kV and 1 mA; compared before and after 0.1 M KOH buffer treatment.

Diffraction StructurePowderRefinement

Powder X-ray diffraction / Pawley-refined XRD

2020 · Ultrafast in Situ Synthesis of Large-Area Conductive Metal-Organic Frameworks on Substrates for Flexible Chemiresistive Sensing

Cu-BHT-5s film on Si/SiO2 · Thin Film · Cu Kalpha radiation; comparison with simulated Cu-BHT pattern

Diffraction StructurePowder

powder X-ray diffraction / synchrotron out-of-plane XRD

2020 · Ultrasensitive Detection of Electrolyte Leakage from Lithium-Ion Batteries by Ionically Conductive Metal-Organic Frameworks

IC-MOF thin film on quartz or silicon wafer · Thin Film · Layer-stacking reflections of MOF thin film indexed as (001) and (002).

Diffraction StructurePowder

powder X-ray diffraction (PXRD)

2020 · Ultrasmall Au(0) Inserted Hollow PCN-222 MOF for the High-Sensitive Detection of Estradiol

HPCN-222 activated powder · Powder · PXRD comparison of HPCN-222 and SPCN-222; AuHPCN-222 and AuSPCN-222 in inset.

Microscopy MorphologyPowder

PXRD, TEM, SAED, AC-HRTEM, SEM and AFM.

2020 · Ultrathin two-dimensional conjugated metal-organic framework single-crystalline nanosheets enabled by surfactant-assisted synthesis

HHB-Ni nanosheets · Nanosheet · Structural and morphological characterisation of SDS-assisted HHB-Ni nanosheets.

Microscopy MorphologyPowder

PXRD, TEM, SAED, AC-HRTEM, SEM and AFM.

2020 · Ultrathin two-dimensional conjugated metal-organic framework single-crystalline nanosheets enabled by surfactant-assisted synthesis

HHTP-Cu nanosheets · Nanosheet · Structural and morphological characterisation of SDS-assisted HHTP-Cu nanosheets.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Cu Kalpha radiation.

2020 · Ultrathin two-dimensional conjugated metal-organic framework single-crystalline nanosheets enabled by surfactant-assisted synthesis

HHB-Cu nanosheets · Nanosheet · Room-temperature PXRD; AB slipped-parallel model assigned from observed reflections.

Diffraction StructurePowder

Powder XRD and FT-IR

2020 · Ultrathin two-dimensional π-d conjugated coordination polymer Co3(hexaaminobenzene)2 nanosheets for highly efficient oxygen evolution

Co-HAB-NSs · Nanosheet · XRD patterns and FT-IR spectra compared for Co-HAB-NSs, Co-HAB-NSs-2, bulk Co-HAB, and Co-HAB-C.

Diffraction StructurePowder

Powder X-ray diffraction using Cu Kalpha source

2020 · Underpinning the conductivity mechanism in wide bandgap metal organic framework through chemical sensing

50-50 Zn:Co ZIF powder · Powder · As-synthesised ZIF-8, ZIF-67, and 50-50 mixture; range 5-90 deg, step size 0.02 deg, Cu Kalpha wavelength 0.15148 nm.

Diffraction StructurePowder

Powder X-ray diffraction and Scherrer crystallite-size analysis

2020 · Understanding the mechanism of high capacitance in nickel hexaaminobenzene-based conductive metal-organic frameworks in aqueous electrolytes

NiHAB powder · Powder · Bruker D8 Advance with Cu Kalpha source; shape factor 0.9; tallest peak at 7.754 degrees 2theta with fwhm 0.597054 degrees 2theta.

Diffraction StructurePowder

Powder XRD comparison

2020 · Valence-Dependent Electrical Conductivity in a 3D Tetrahydroxyquinone-Based Metal-Organic Framework

FeTHQ_redox2 · Pellet · PXRD comparison of as-prepared FeTHQ, oxidised FeTHQ_ox, reduced FeTHQ_red samples, and redox samples.

Diffraction StructurePowderRefinement

Synchrotron powder XRD and Rietveld refinement

2020 · Valence-Dependent Electrical Conductivity in a 3D Tetrahydroxyquinone-Based Metal-Organic Framework

FeTHQ as-prepared powder · Powder · FeTHQ powder in 1 mm Kapton capillary measured at APS 17-BM with lambda = 0.44811 A; GSAS-II conversion and TOPAS refinement.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD), Bruker D8 advance with Cu Ka radiation

2019 · 3D self-branched zinc-cobalt Oxide@N-doped carbon hollow nanowall arrays for high-performance asymmetric supercapacitors and oxygen electrocatalysis

3D self-branched ZnCo2O4@NC/CTs · Electrode · Phase purity and crystallinity of CTs, Co-MOF/CTs, ZnCo-MOF/CTs, Co3O4@NC/CTs, ZnCo2O4/CTs and ZnCo2O4@NC/CTs.

Diffraction StructurePowder

powder X-ray diffraction (Shimadzu XRD-6000, Cu Kalpha)

2019 · A Copper Coordination Polymer with Matching Energy Level for Modifying Hole Transport Layers to Improve the Performance of Perovskite Solar Cells

as-prepared Cu-bix pale-yellow crystals · Single Crystal · Experimental PXRD compared with simulated pattern.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2019 · A Copper Coordination Polymer with Matching Energy Level for Modifying Hole Transport Layers to Improve the Performance of Perovskite Solar Cells

as-prepared Cu-bix pale-yellow crystals · Single Crystal · As-prepared Cu-bix crystal structure determined; hydrogen atoms omitted in Figure 1.

Diffraction StructureUnspecified subtype

XRD of perovskite film on TiO2/FTO

2019 · A Copper Coordination Polymer with Matching Energy Level for Modifying Hole Transport Layers to Improve the Performance of Perovskite Solar Cells

optimised Cu-bix-doped PSC · Electrode · Perovskite film phase check on TiO2/FTO substrate.

Diffraction StructurePowderRefinement

powder X-ray diffraction with Rietveld refinement

2019 · A highly crystalline anthracene-based MOF-74 series featuring electrical conductivity and luminescence

ANMOF-74(Co) bulk powder · Powder · PXRD pattern calculated/refined against model structure; XRD with Ni-filtered Cu Kalpha radiation in Bragg-Brentano geometry per SI methods.

Diffraction StructurePowderRefinement

powder X-ray diffraction with Rietveld refinement

2019 · A highly crystalline anthracene-based MOF-74 series featuring electrical conductivity and luminescence

ANMOF-74(Mg) bulk powder · Powder · PXRD pattern calculated/refined against model structure; XRD with Ni-filtered Cu Kalpha radiation in Bragg-Brentano geometry per SI methods.

Diffraction StructurePowderRefinement

powder X-ray diffraction with Rietveld refinement

2019 · A highly crystalline anthracene-based MOF-74 series featuring electrical conductivity and luminescence

ANMOF-74(Mn) bulk powder · Powder · PXRD pattern calculated/refined against model structure; XRD with Ni-filtered Cu Kalpha radiation in Bragg-Brentano geometry per SI methods.

Diffraction StructurePowderRefinement

powder X-ray diffraction with Rietveld refinement

2019 · A highly crystalline anthracene-based MOF-74 series featuring electrical conductivity and luminescence

ANMOF-74(Ni) bulk powder · Powder · PXRD pattern calculated/refined against model structure; XRD with Ni-filtered Cu Kalpha radiation in Bragg-Brentano geometry per SI methods.

Diffraction StructurePowderRefinement

powder X-ray diffraction with Rietveld refinement

2019 · A highly crystalline anthracene-based MOF-74 series featuring electrical conductivity and luminescence

ANMOF-74(Zn) bulk powder · Powder · PXRD pattern calculated/refined against model structure; XRD with Ni-filtered Cu Kalpha radiation in Bragg-Brentano geometry per SI methods.

Diffraction StructurePowder

PXRD stability tests

2019 · A Highly Proton-Conductive 3D Ionic Cadmium-Organic Framework for Ammonia and Amines Impedance Sensing

MOF 1 water- and pH-treated stability samples · Powder · Samples soaked in water for 1 month, refluxed in water for 24 h, or soaked in pH 1-11 aqueous solutions for 24 h.

Diffraction StructurePowder

X-ray powder diffraction (XRD)

2019 · A Li+ conductive metal organic framework electrolyte boosts the high-temperature performance of dendrite-free lithium batteries

ZIF-67 MOF powder · Powder · 2theta range 5-90 deg at 2 deg min-1; Cu Kalpha radiation, 40 kV and 40 mA.

Diffraction StructurePowder

PXRD with Cu K-alpha radiation

2019 · A semiconducting layered metal-organic framework magnet

as-synthesised K3Fe2[PcFe-O8] dark black powder · Powder · Powder X-ray diffraction compared with calculated stacking patterns.

Diffraction StructurePowder

PXRD, FT-IR, solid-state 13C NMR, XPS, SEM/TEM

2019 · A two-dimensional semiconducting covalent organic framework with nickel(II) coordination for high capacitive performance

Ni0-COF powder · Powder · Control framework characterisation in SI figures S3-S16 and Table S2.

Diffraction StructureUnspecified subtype

X-ray diffraction after cycling

2019 · Bottom-Up Fabrication of 1D Cu-based Conductive Metal–Organic Framework Nanowires as a High-Rate Anode towards Efficient Lithium Storage

Cu-CAT NW electrode after 100 cycles · Electrode · XRD pattern of Cu-CAT NW electrode after the 100th cycle.

Diffraction StructureUnspecified subtype

Wide-angle X-ray diffraction

2019 · Bottom-Up Fabrication of 1D Cu-based Conductive Metal–Organic Framework Nanowires as a High-Rate Anode towards Efficient Lithium Storage

as-obtained Cu-CAT NWs · Powder · Bruker D8 Advance diffractometer with Cu Kalpha radiation; scanning rate 5 deg min^-1.

Diffraction StructureUnspecified subtype

X-ray diffraction with Cu K-alpha radiation

2019 · Catalytic Metal Nanoparticles Embedded in Conductive Metal–Organic Frameworks for Chemiresistors: Highly Active and Conductive Porous Materials

Cu3(HHTP)2, Pd@Cu3(HHTP)2, and Pt@Cu3(HHTP)2 powder comparison set · Powder · Crystal structures and (004) z-axis lattice spacing refined for pristine and Pd/Pt-loaded powders.

Diffraction StructurePowderRefinement

Powder X-ray diffraction and Rietveld refinement

2019 · Chemiresistive Detection of Gaseous Hydrocarbons and Interrogation of Charge Transport in Cu[Ni(2,3-pyrazinedithiolate) 2 ] by Gas Adsorption

Activated Cu[Ni(pdt)2] powder · Powder · Fully desolvated Cu[Ni(pdt)2] loaded in 1.0 mm borosilicate capillary inside N2 glovebox; synchrotron PXRD at 298 K; wavelength 0.45212 A for refinement.

Diffraction StructurePowder

Synchrotron powder X-ray diffraction under C2H2 dosing

2019 · Chemiresistive Detection of Gaseous Hydrocarbons and Interrogation of Charge Transport in Cu[Ni(2,3-pyrazinedithiolate) 2 ] by Gas Adsorption

C2H2-dosed Cu[Ni(pdt)2] capillary PXRD sample · Powder · C2H2 pressures of 20, 92, 291, 591, and 1077 mbar at 298 K; patterns consistent with P42/mmc and refined by Rietveld/Pawley methods.

Diffraction StructurePowder

Synchrotron powder X-ray diffraction under C2H4 dosing

2019 · Chemiresistive Detection of Gaseous Hydrocarbons and Interrogation of Charge Transport in Cu[Ni(2,3-pyrazinedithiolate) 2 ] by Gas Adsorption

C2H4-dosed Cu[Ni(pdt)2] capillary PXRD sample · Powder · C2H4 pressures of 24, 88, 273, 589, and 985 mbar at 298 K; patterns consistent with P42/mmc and refined by Rietveld/Pawley methods.

Diffraction StructurePowder

PXRD

2019 · Co 3 O 4 @Cu-Based Conductive Metal–Organic Framework Core–Shell Nanowire Electrocatalysts Enable Efficient Low-Overall-Potential Water Splitting

Co3O4@CuCAT optimal core-shell electrode · Electrode · Powder XRD comparison of Co3O4, CuCAT and Co3O4@CuCAT.

Diffraction StructurePowder

PXRD

2019 · Co 3 O 4 @Cu-Based Conductive Metal–Organic Framework Core–Shell Nanowire Electrocatalysts Enable Efficient Low-Overall-Potential Water Splitting

CuCAT powder · Powder · CuCAT before and after immersion in 1 M KOH for 3 days; comparison with Figure S2c.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2019 · CO2 Behavior in a Highly Selective Ultramicroporous Framework: Insights from Single-Crystal X-ray Diffraction and Solid-State Nuclear Magnetic Resonance Spectroscopy

As-made SIFSIX-3-Zn · Powder · Experimental PXRD pattern of as-made SIFSIX-3-Zn compared with simulated pattern from reported as-made crystal structure; Cu Kalpha source, lambda = 1.5418 A, 2theta from 5 to 120 deg.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SCXRD)

2019 · CO2 Behavior in a Highly Selective Ultramicroporous Framework: Insights from Single-Crystal X-ray Diffraction and Solid-State Nuclear Magnetic Resonance Spectroscopy

CO2-saturated SIFSIX-3-Zn single crystals · Single Crystal · CO2-loaded single crystals measured on a Bruker-Nonius KappaCCD Apex2 diffractometer at 110 K using Cu Kalpha radiation; structure solved with SHELXT and refined with SHELXL-2014.

Diffraction StructurePowder

ex situ PXRD during discharge-charge

2019 · Conductive 2D metal-organic framework for high-performance cathodes in aqueous rechargeable zinc batteries

fully discharged Cu3(HHTP)2 electrode · Electrode · PXRD on Cu3(HHTP)2 electrode in pristine, first fully discharged, first fully charged, and 500th fully charged states.

Diffraction StructurePowderRefinement

PXRD with Rietveld refinement

2019 · Conductive 2D metal-organic framework for high-performance cathodes in aqueous rechargeable zinc batteries

as-synthesised Cu3(HHTP)2 powder / nanorods · Powder · PXRD with Cu-Kalpha1 radiation in transmission geometry; 2theta range 2-90 deg, step 0.015 deg, 40 kV and 40 mA.

Diffraction StructureUnspecified subtype

XRD before and after 150 degC heating

2019 · Conductive metal–organic framework with redox metal center as cathode for high rate performance lithium ion battery

Heat-treated Cu3(HHTP)2 powder · Powder · Cu3(HHTP)2 powder compared before and after heating at 150 degC to remove DMF.

Diffraction StructurePowder

PXRD with Rigaku Smartlab 9 kW, Cu Kalpha radiation

2019 · Conductive metal–organic framework with redox metal center as cathode for high rate performance lithium ion battery

Cu3(HHTP)2 crystalline powder · Powder · 2theta range 3-40 deg; experimental pattern compared with slipped-parallel and eclipsed simulated stacking models.

OtherUnspecified subtype

Polysulfide adsorption test and post-adsorption XRD

2019 · Conductive MOF-Modified Separator for Mitigating the Shuttle Effect of Lithium-Sulfur Battery through a Filtration Method

Ni3(HITP)2 powder after Li2S6 adsorption · Powder · Ni3(HITP)2 powder added to 0.3 mM Li2S6 solution; XRD after adsorption.

SpectroscopyUnspecified subtype

XRD and FTIR

2019 · Conductive MOF-Modified Separator for Mitigating the Shuttle Effect of Lithium-Sulfur Battery through a Filtration Method

Ni3(HITP)2 after Li-S cell cycling/discharge · Powder · XRD before/after cycling and FTIR of pristine and discharged Ni3(HITP)2.

Diffraction StructureUnspecified subtype

X-ray diffraction, Cu Kalpha radiation

2019 · Conductive MOF-Modified Separator for Mitigating the Shuttle Effect of Lithium-Sulfur Battery through a Filtration Method

Ni3(HITP)2-modified separator · Thin Film · XRD comparison of Ni3(HITP)2 modified on PP with simulated and powder patterns.

Diffraction StructureUnspecified subtype

X-ray diffraction, Cu Kalpha radiation

2019 · Conductive MOF-Modified Separator for Mitigating the Shuttle Effect of Lithium-Sulfur Battery through a Filtration Method

As-synthesised Ni3(HITP)2 powder · Powder · XRD comparison of synthesised Ni3(HITP)2 with simulated MOF pattern.

Diffraction StructureUnspecified subtype

Ex situ XRD during first charge-discharge cycle

2019 · Construction of 1D conductive Ni-MOF nanorods with fast Li+ kinetic diffusion and stable high-rate capacities as an anode for lithium ion batteries

Ni-CAT nanorod lithium-ion battery anode electrode · Electrode · XRD patterns during discharge to 1.0/0.5/0.01 V and charge to 1.5/3.0 V; used to infer structural change and recovery.

OtherUnspecified subtype

Lithiation/de-lithiation site assignment from XPS and ex situ XRD

2019 · Construction of 1D conductive Ni-MOF nanorods with fast Li+ kinetic diffusion and stable high-rate capacities as an anode for lithium ion batteries

Ni-CAT nanorod lithium-ion battery anode electrode · Electrode · Proposed Li storage sites: benzene rings, pores and interlaminar space; supported by C-Li XPS peak and ex situ XRD c-axis changes.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD) and crystal-structure model

2019 · Construction of 1D conductive Ni-MOF nanorods with fast Li+ kinetic diffusion and stable high-rate capacities as an anode for lithium ion batteries

As-synthesised Ni-CAT nanorods · Powder · XRD collected on BREKER-D8ADVANCE at 20 deg min-1; compared with Ni-CAT honeycomb model.

Diffraction StructureUnspecified subtype

post-OER/ORR XRD and SEM

2019 · Copper-based conductive metal organic framework in-situ grown on copper foam as a bifunctional electrocatalyst

Cu3HITP2/CF · Electrode · XRD and SEM after OER and ORR used to assess phase/morphology stability.

Diffraction StructurePowder

powder X-ray diffraction

2019 · Copper-based conductive metal organic framework in-situ grown on copper foam as a bifunctional electrocatalyst

powder/delaminated Cu3HITP2 · Powder · Bruker D8 Advance XRD; wavelength 0.154056 nm; 60 kV; 4-30 deg 2theta; scan rate 0.5 deg s-1.

Diffraction StructureUnspecified subtype

XRD

2019 · Copper-Metal Organic Frameworks Electrodeposited on Carbon Paper as an Enhanced Cathode for the Hydrogen Evolution Reaction

HKUST-1 ED on carbon paper · Electrode · XRD pattern of electrodeposited HKUST-1 ED on carbon paper.

Diffraction StructureUnspecified subtype

XRD

2019 · Copper-Metal Organic Frameworks Electrodeposited on Carbon Paper as an Enhanced Cathode for the Hydrogen Evolution Reaction

HKUST-1 HT powder/crystals · Powder · XRD pattern of hydrothermal HKUST-1 compared with simulated HKUST-1.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Diverse π-π Stacking motifs modulate electrical conductivity in tetrathiafulvalene-based metal-organic frameworks

As-synthesised bulk powder of compound 1 · Powder · Cu Kalpha Bragg-Brentano PXRD on powders; compared with simulated SCXRD patterns and activation states.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Diverse π-π Stacking motifs modulate electrical conductivity in tetrathiafulvalene-based metal-organic frameworks

As-synthesised bulk powder of compound 2 · Powder · Cu Kalpha Bragg-Brentano PXRD on powders; compared with simulated SCXRD patterns and activation states.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Diverse π-π Stacking motifs modulate electrical conductivity in tetrathiafulvalene-based metal-organic frameworks

As-synthesised bulk powder of compound 3 · Powder · Cu Kalpha Bragg-Brentano PXRD on powders; compared with simulated SCXRD patterns and activation states.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2019 · Efficient MOF-Sensitized Solar Cells Featuring Solvothermally Grown [100]-Oriented Pillared Porphyrin Framework-11 Films on ZnO/FTO Surfaces

bulk PPF-11 crystals · Single Crystal · Cu Kalpha radiation, Rigaku Ultima IV; as-synthesised crystals

Diffraction StructurePowder

PXRD after C60 infiltration

2019 · Efficient MOF-Sensitized Solar Cells Featuring Solvothermally Grown [100]-Oriented Pillared Porphyrin Framework-11 Films on ZnO/FTO Surfaces

C60-doped PPF-11 crystals · Powder · C60-doped PPF-11 compared with undoped/bulk and films

Diffraction StructurePowder

PXRD

2019 · Efficient MOF-Sensitized Solar Cells Featuring Solvothermally Grown [100]-Oriented Pillared Porphyrin Framework-11 Films on ZnO/FTO Surfaces

[100]-oriented PPF-11 film on TCPP-coated ZnO-FTO · Electrode · Solvothermally grown PPF-11/ZnO film on ZnO-FTO

Diffraction StructurePowderRefinement

cRED / MicroED and PXRD Pawley fitting

2019 · Electrocatalytic Hydrogen Evolution from a Cobaloxime-Based Metal-Organic Framework Thin Film

Bulk UU-100(Co) powder · Powder · cRED under cryogenic conditions; PXRD Cu K-alpha; structural model refined with DFT.

Diffraction StructurePowder

Post-electrolysis PXRD, SEM, and SEM-EDX

2019 · Electrocatalytic Hydrogen Evolution from a Cobaloxime-Based Metal-Organic Framework Thin Film

UU-100(Co)|GC thin-film electrode · Electrode · UU-100(Co)|GC after 3 h, 5 h, 6 h, and 18 h electrolysis at -0.45 V vs RHE in acetate buffer pH 4.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2019 · Enhancement of Electrical Conductivity due to Structural Distortion from Linear to Nonlinear Dicarboxylato-Bridged Zn(II) 1D-Coordination Polymers

Compound 1 bulk crystals/powder · Single Crystal · Bruker D8 Advance; Mo Kalpha radiation lambda=0.71075 A, 40 kV/40 mA; 2theta 5-50 deg, room temperature.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Enhancement of Electrical Conductivity due to Structural Distortion from Linear to Nonlinear Dicarboxylato-Bridged Zn(II) 1D-Coordination Polymers

Compound 1 bulk crystals/powder · Single Crystal · Rigaku FRX RA generator with P200 detector; Mo Kalpha radiation, lambda = 0.71073 A; data collection at 93 K.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2019 · Enhancement of Electrical Conductivity due to Structural Distortion from Linear to Nonlinear Dicarboxylato-Bridged Zn(II) 1D-Coordination Polymers

Compound 2 bulk crystals/powder · Single Crystal · Bruker D8 Advance; Mo Kalpha radiation lambda=0.71075 A, 40 kV/40 mA; 2theta 5-50 deg, room temperature.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Enhancement of Electrical Conductivity due to Structural Distortion from Linear to Nonlinear Dicarboxylato-Bridged Zn(II) 1D-Coordination Polymers

Compound 2 bulk crystals/powder · Single Crystal · Bruker SMART APEX II diffractometer; Mo Kalpha radiation, lambda = 0.71073 A; data collection at 293(2) K.

Microscopy MorphologyUnspecified subtype

SEM and XRD after electrochemical cycling/soaking

2019 · Exposing {001} Crystal Plane on Hexagonal Ni-MOF with Surface-Grown Cross-Linked Mesh-Structures for Electrochemical Energy Storage

Y3 · Powder · Y3 after 5000 three-electrode cycles and Y3 after soaking in 3.0 M KOH for 24 h.

Diffraction StructureUnspecified subtype

crystal-structure assignment from XRD and model

2019 · Exposing {001} Crystal Plane on Hexagonal Ni-MOF with Surface-Grown Cross-Linked Mesh-Structures for Electrochemical Energy Storage

Y1-Y5 hexagonal Ni-MOF powders · Powder · Structure viewed along ab-axis and perpendicular to 2D layer.

Diffraction StructureUnspecified subtype

XRD

2019 · Exposing {001} Crystal Plane on Hexagonal Ni-MOF with Surface-Grown Cross-Linked Mesh-Structures for Electrochemical Energy Storage

Y1-Y5 hexagonal Ni-MOF powders · Powder · Powder XRD patterns for Y1-Y5 samples.

Diffraction StructurePowder

powder X-ray diffraction

2019 · Fabrication of 3D Co-doped Ni-based MOF hierarchical micro-flowers as a high-performance electrode material for supercapacitors

Ni-MOF powder · Powder · Powder XRD patterns collected for Ni-MOF and Co0.5/Co2/Co5-Ni-MOF samples.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2019 · Field-Effect Transistor Based on an in Situ Grown Metal-Organic Framework Film as a Liquid-Gated Sensing Device

Ni-MOF powder · Powder · PXRD comparison of Ni-MOF powders and films.

Diffraction StructurePowder

Powder XRD and small-angle XRD

2019 · From Low-to High-Crystallinity Bimetal-Organic Framework Nanosheet with Highly Exposed Boundaries: An Efficient and Stable Electrocatalyst for Oxygen Evolution Reaction

(U+S)-CoFe-MOF hierarchical nanosheets · Nanosheet · Cu Kalpha XRD; comparison of U+S, U and S CoFe-MOF crystal structures, water/NMP stability, and mesopore-related small-angle peaks.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Functionality in metal-organic framework minerals: Proton conductivity, stability and potential for polymorphism

ST2 crystals · Single Crystal · ST2, ST1d and ST2d structures determined with a Bruker D8 APEX2 diffractometer and MoKa radiation; ST1/ST2 crystallographic parameters tabulated.

Diffraction StructurePowder

Variable-temperature powder X-ray diffraction

2019 · Functionality in metal-organic framework minerals: Proton conductivity, stability and potential for polymorphism

ST1 crystals · Single Crystal · Powdered ST1 and ST2 heated 2 deg C per hour from 25 deg C to 110 deg C, then exposed to 100% RH at room temperature.

Diffraction StructurePowder

Powder X-ray diffraction using Cu K alpha radiation

2019 · General Synthesis of Mixed Semiconducting Metal Oxide Hollow Spheres with Tunable Compositions for Low-Temperature Chemiresistive Sensing

Ni-Co-Fe-Cu-Zn-TA-400 · Powder · Transmission geometry, 40 mA and 40 kV, scan rate 2 degrees/min, step size 0.02 degrees.

Diffraction StructurePowder

XRPD

2019 · Guest-Assisted Proton Conduction in the Sulfonic Mesoporous MIL-101 MOF

H2SO4(1M)@MIL-101(Cr)-NH-(CH2)3SO3H powder · Powder · Before and after conductivity measurements.

Diffraction StructurePowder

XRPD

2019 · Guest-Assisted Proton Conduction in the Sulfonic Mesoporous MIL-101 MOF

MIL-101(Cr)-NO2 powder · Powder · Powder X-ray diffraction compared with MIL-101(Cr) pattern.

Diffraction StructurePowder

XRPD

2019 · Guest-Assisted Proton Conduction in the Sulfonic Mesoporous MIL-101 MOF

MIL-101(Cr)-NH-(CH2)3SO3H powder · Powder · Before and after conductivity measurements.

Diffraction StructurePowder

XRPD

2019 · Guest-Assisted Proton Conduction in the Sulfonic Mesoporous MIL-101 MOF

Washed H2SO4(1M)@MIL-101(Cr)-NH-(CH2)3SO3H powder · Powder · Washed H2SO4-loaded sample after conductivity measurements.

Diffraction StructurePowder

Powder X-ray diffraction (Cu K alpha)

2019 · Highly Conductive Bimetallic Ni-Fe Metal Organic Framework as a Novel Electrocatalyst for Water Oxidation

FeNi-DOBDC-3 · Nanosheet · D8 ADVANCE diffractometer; compared Ni-MOF, FeNi-DOBDC-3, Fe-complex, simulated MOF-74 and SI precursor variants.

Diffraction StructurePowder

Powder X-ray diffraction stability checks

2019 · Highly Electroconductive Metal-Organic Framework: Tunable by Metal Ion Sorption Quantity

TMU-60-Cd powder · Powder · XRD patterns after conductivity/electrochemical tests and after K3Fe(CN)6 redox process compared with simulated/pristine TMU-60.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Highly Electroconductive Metal-Organic Framework: Tunable by Metal Ion Sorption Quantity

activated TMU-60 crystals · Powder · Bruker APEX area-detector; graphite monochromated Mo-Kalpha radiation, lambda = 0.71073 A; 298 K.

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction; SHELX-97 refinement

2019 · Influence of Axial Linkers on Polymerization in Paddle-Wheel Cu(II) Coordination Polymers for the Application of Optoelectronics Devices

compound 1 blue needle-shaped crystals · Single Crystal · Bruker SMART APEX II, graphite-monochromated Mo Kalpha radiation, lambda = 0.71073 A.

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction; SHELX-97 refinement

2019 · Influence of Axial Linkers on Polymerization in Paddle-Wheel Cu(II) Coordination Polymers for the Application of Optoelectronics Devices

compound 2 blue block-shaped crystals · Single Crystal · Bruker SMART APEX II, graphite-monochromated Mo Kalpha radiation, lambda = 0.71073 A.

Diffraction StructurePowder

TGA and PXRD

2019 · Influence of Axial Linkers on Polymerization in Paddle-Wheel Cu(II) Coordination Polymers for the Application of Optoelectronics Devices

compound 1 blue needle-shaped crystals · Single Crystal · TGA 30-600 deg C under nitrogen at 12 deg C min-1; PXRD with Cu Kalpha radiation, 2theta = 5-50 deg.

Diffraction StructurePowder

TGA and PXRD

2019 · Influence of Axial Linkers on Polymerization in Paddle-Wheel Cu(II) Coordination Polymers for the Application of Optoelectronics Devices

compound 2 blue block-shaped crystals · Single Crystal · TGA 30-600 deg C under nitrogen at 12 deg C min-1; PXRD with Cu Kalpha radiation, 2theta = 5-50 deg.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Integration of a (–Cu–S–) n plane in a metal–organic framework affords high electrical conductivity

As-synthesised brown rod-shaped crystals of compound 1 · Single Crystal · Siemens D-5000 diffractometer, Cu Kalpha, 40 kV, 40 mA, step size 0.02 deg, scan speed 0.52 s per step.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Integration of a (–Cu–S–) n plane in a metal–organic framework affords high electrical conductivity

As-synthesised brown rod-shaped crystals of compound 1 · Single Crystal · Bruker-Nonius Kappa CCD; Mo Kalpha radiation, lambda = 0.71073 A; crystal data at 200(2) K.

Diffraction StructurePowder

PXRD after electrical impedance spectroscopy

2019 · Li + Ion-Conducting Sulfonate-Based Neutral Metal-Organic Framework

LiClO4-treated Cu(I)-sulfonate MOF pellet · Pellet · Crushed MOF pellets after electrical measurements compared with pre-EIS patterns.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2019 · Li + Ion-Conducting Sulfonate-Based Neutral Metal-Organic Framework

Activated pristine [Cu2(BPY)2(NDIDS)] MOF powder · Powder · Room-temperature PXRD with Cu Kalpha radiation; compared pristine, LiClO4-treated, Bu4NClO4-treated and simulated patterns.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SXRD)

2019 · Li + Ion-Conducting Sulfonate-Based Neutral Metal-Organic Framework

As-synthesised Cu(I)-sulfonate MOF single crystals · Single Crystal · Single crystal measured at 120(2) K; Bruker SHELXTL/SHELXT/SHELXL structure solution and refinement.

Diffraction StructurePowder

Powder X-ray diffraction from rendered SI Figure S1

2019 · Metal organic framework doped Spiro-OMeTAD with increased conductivity for improving perovskite solar cell performance

Synthesised In10 MOF powder · Powder · Rendered SI Figure S1 shows the In10 powder XRD pattern over approximately 5-50 degrees 2theta.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Metal organic framework doped Spiro-OMeTAD with increased conductivity for improving perovskite solar cell performance

Synthesised In10 MOF powder · Powder · Shimadzu XRD-6000 used to study X-ray diffraction; XRD pattern confirming In10 synthesis is in Fig. S1.

Diffraction StructurePowder

pXRD and SEM side-view imaging

2019 · Metal-Organic Framework Photoconductivity via Time-Resolved Terahertz Spectroscopy

Zn2TTFTB thin film on FTO · Thin Film · Zn2TTFTB thin film on FTO checked for crystallinity and thickness.

Diffraction StructurePowder

Post-TRTS pXRD

2019 · Metal-Organic Framework Photoconductivity via Time-Resolved Terahertz Spectroscopy

As-prepared Zn2TTFTB tape-cell sample · Powder · Powder X-ray diffraction after TRTS beam exposure.

OtherUnspecified subtype

XRD, FTIR, SEM, TEM/EDS, TGA, ICP, XPS, Raman, BET

2019 · Metal-organic framework-mediated synthesis of LiNi0.5Mn1.5O4: Tuning the Mn3+ content and electrochemical performance by organic ligands

PTCDA-LNMO powder · Powder · Characterisation instrument details reported for all Ni-Mn-MOF and LNMO samples.

Diffraction StructurePowder

ATR-FTIR and PXRD after nanoprocessing

2019 · Multifunctional coordination polymers based on copper with modified nucleobases, easily modulated in size and conductivity

nanoCP1 supernatant flakes · Nanosheet · IR spectroscopy and powder X-ray diffraction of CP1 before and after sonication.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Multifunctional coordination polymers based on copper with modified nucleobases, easily modulated in size and conductivity

CP1 polycrystalline/powder sample · Powder · PANalytical X'Pert PRO MPD theta/2theta; experimental pattern compared with simulated pattern.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Multifunctional coordination polymers based on copper with modified nucleobases, easily modulated in size and conductivity

CP1 turquoise needle-shaped single crystals · Single Crystal · Mo Kalpha radiation, lambda = 0.71073 A; Bruker Kappa Apex II; SADABS correction; SIR92/SHELXL refinement.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Multifunctional coordination polymers based on copper with modified nucleobases, easily modulated in size and conductivity

CP2 light-blue single crystals · Single Crystal · Experimental PXRD pattern compared with simulated pattern.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Multifunctional coordination polymers based on copper with modified nucleobases, easily modulated in size and conductivity

CP2 light-blue single crystals · Single Crystal · Mo Kalpha radiation, lambda = 0.71073 A; Bruker Kappa Apex II; SADABS correction; SIR92/SHELXL refinement.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Multifunctional coordination polymers based on copper with modified nucleobases, easily modulated in size and conductivity

CP3 yellow single crystals · Single Crystal · Experimental PXRD pattern compared with simulated pattern.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Multifunctional coordination polymers based on copper with modified nucleobases, easily modulated in size and conductivity

CP3 yellow single crystals · Single Crystal · Mo Kalpha radiation, lambda = 0.71073 A; Bruker Kappa Apex II; SADABS correction; SIR92/SHELXL refinement.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Nanocubic bimetallic organic framework self-templated from Ni precursor as efficient electrocatalysts for oxygen evolution reaction

MIL-53(Fe) · Powder · XRD pattern compared with simulated/reported MIL-53(Fe).

Diffraction StructurePowder

Powder X-ray diffraction (Cu Kalpha)

2019 · Nanocubic bimetallic organic framework self-templated from Ni precursor as efficient electrocatalysts for oxygen evolution reaction

Ni NCs@MIL-53(NiFe), optimised Ni NCs:FeCl2 mass ratio 3 · Powder · Bruker D8 Advance powder diffractometer, Cu Kalpha radiation, lambda = 1.5418 A.

Diffraction StructurePowder

powder XRD

2019 · Nanoporous gold induced vertically standing 2D NiCo bimetal-organic framework nanosheets for non-enzymatic glucose biosensing

bulk NiCo-MOFNs precipitates from precursor solution · Powder · 5-35 deg 2theta selected to avoid Au peaks; bulk NiCo-MOFNs powder on gold plate used as proxy for NPG-supported phase

Diffraction StructureGrazing incidence

SEM and GIWAXS

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Cu-CAT-1 on ITO agglomerate control · Thin Film · Control experiment for Cu-CAT-1 growth on ITO.

Diffraction StructureGrazing incidence

GIWAXS and SEM

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Oriented Co-CAT-1 thin film on glass · Thin Film · Glass-supported Co-CAT-1 film orientation and morphology.

Diffraction StructureGrazing incidence

GIWAXS, SEM, TEM and AFM

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Oriented Co-CAT-1 thin film on gold · Thin Film · 2D GIWAXS indexed to M-CAT-1; SEM cross-sections/top-view, TEM after removing film, AFM surface roughness.

Diffraction StructureGrazing incidence

GIWAXS, SEM and AFM

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Co-CAT-1 film on ITO · Thin Film · Oxide-supported film orientation and morphology.

Microscopy MorphologyUnspecified subtype

XRD detector scan, SEM, AFM

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Oriented Cu-CAT-1 thin film on gold from copper nitrate trihydrate · Thin Film · Cu-CAT-1 film from copper nitrate trihydrate precursor on gold.

Diffraction StructureGrazing incidence

GIWAXS, SEM, TEM and AFM

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Oriented Cu-CAT-1 film on gold from copper trifluoroacetylacetonate · Thin Film · 2D GIWAXS indexed to M-CAT-1; SEM cross-sections/top-view, TEM after removing film, AFM surface roughness.

Diffraction StructureGrazing incidence

GIWAXS and SEM

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Oriented Ni-CAT-1 thin film on glass · Thin Film · Glass-supported Ni-CAT-1 film orientation and morphology.

Diffraction StructureGrazing incidence

GIWAXS, SEM, TEM and AFM

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Oriented Ni-CAT-1 thin film on gold · Thin Film · 2D GIWAXS indexed to M-CAT-1; SEM cross-sections/top-view, TEM after removing film, AFM surface roughness.

Diffraction StructureGrazing incidence

GIWAXS, SEM and AFM

2019 · Oriented Thin Films of Electroactive Triphenylene Catecholate-Based Two-Dimensional MetalOrganic Frameworks

Oriented Ni-CAT-1 thin film on ITO · Thin Film · Oxide-supported film orientation and morphology.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Porous Molecular Conductor: Electrochemical Fabrication of Through-Space Conduction Pathways among Linear Coordination Polymers

PMC-1 bulk powder/crystals · Powder · Bruker D2 PHASER, Cu Kalpha radiation lambda = 1.5406 A at room temperature.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SXRD)

2019 · Porous Molecular Conductor: Electrochemical Fabrication of Through-Space Conduction Pathways among Linear Coordination Polymers

PMC-1 single crystal · Single Crystal · Rigaku Saturn 724+ CCD; graphite-monochromated Mo Kalpha radiation; structure solved by SHELXT and refined with SHELXL; SQUEEZE applied.

Diffraction StructurePowder

High-resolution multi-temperature synchrotron PXRD

2019 · Porous Molecular Conductor: Electrochemical Fabrication of Through-Space Conduction Pathways among Linear Coordination Polymers

PMC-1s pressed pellet · Pellet · SPring-8 BL02B2; lambda = 1.08 A; temperatures 100, 300, and 400 K controlled with nitrogen gas flow.

Diffraction StructureWide / small angle scattering

Small-angle X-ray scattering (SAXS)

2019 · Redox-Active 1D Coordination Polymers of Iron-Sulfur Clusters

Compound 2 in DMF solution · Unknown · Near-saturated solution of 2 in dry DMF, approximately 2 mg/mL, filtered through 0.2 um PET; ambient temperature.

Diffraction StructurePowderRefinement

HRTEM/FFT plus synchrotron PXRD and Pawley refinement.

2019 · Single Crystals of Electrically Conductive Two-Dimensional Metal-Organic Frameworks: Structural and Electrical Transport Properties

Cu3(HHTP)2 rods · Single Crystal · Cu3(HHTP)2 rods/flakes imaged by HRTEM; washed powder dried under dynamic vacuum, packed in air into Kapton capillary and measured by synchrotron PXRD at 295 K.

Diffraction StructurePowder

Powder X-ray diffraction

2019 · Synthesis, Crystal Structure, and Photocatalytic Properties of a Zinc(II) Coordination Polymer Based on 3-Hydroxy-2-pyridinecarboxylic Acid

Complex 1 bulk crystalline product · Powder · Rigaku D/Max-2500PC, Cu-Kalpha radiation (lambda = 1.5418 Angstrom), 2theta = 10-50 deg, room temperature; compared with simulated single-crystal pattern.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2019 · Synthesis, Crystal Structure, and Photocatalytic Properties of a Zinc(II) Coordination Polymer Based on 3-Hydroxy-2-pyridinecarboxylic Acid

Complex 1 single crystal · Single Crystal · Agilent GeminiE diffractometer, Mo-Kalpha radiation (lambda = 0.71073 Angstrom), omega-2theta scanning, 293 K; structure solved with SHELX-XL and refined with SHELXL-XT.

Diffraction StructurePowder

powder X-ray diffraction; Bruker D8 Advance, Cu Kalpha radiation

2019 · Three-Dimensional-Coordination Polymer of Zn(II)-Carboxylate: Structural Elucidation, Photoelectrical Conductivity, and Biological Activity

as-synthesised brown crystals of compound 1 · Single Crystal · Grinded sample; 2theta range 5-50 degrees; simulated room-temperature and as-synthesised patterns compared for compound 1 and ppmh.

Diffraction StructurePowder

powder X-ray diffraction

2019 · Triphenylene-Bridged Trinuclear Complexes of Cu: Models for Spin Interactions in Two-Dimensional Electrically Conductive Metal-Organic Frameworks

microcrystalline sample of complex 1 · Powder · Bruker Advance II, Cu Kalpha radiation, 40 kV/40 mA, 2 steps per second; thin layer on zero-background silicon plate.

Diffraction StructurePowder

powder X-ray diffraction

2019 · Triphenylene-Bridged Trinuclear Complexes of Cu: Models for Spin Interactions in Two-Dimensional Electrically Conductive Metal-Organic Frameworks

microcrystalline sample of complex 2 · Powder · Bruker Advance II, Cu Kalpha radiation, 40 kV/40 mA, 2 steps per second; thin layer on zero-background silicon plate.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2019 · Triphenylene-Bridged Trinuclear Complexes of Cu: Models for Spin Interactions in Two-Dimensional Electrically Conductive Metal-Organic Frameworks

dark blue needle-shaped crystals of complex 1 · Single Crystal · Bruker D8/APEX-II CCD, Mo Kalpha radiation, 100(2) K; SHELXS/SHELXL-13 refinement.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2019 · Triphenylene-Bridged Trinuclear Complexes of Cu: Models for Spin Interactions in Two-Dimensional Electrically Conductive Metal-Organic Frameworks

dark blue plate-shaped crystals of complex 2 · Single Crystal · Bruker D8/APEX-II CCD, Mo Kalpha radiation, 100(2) K; SHELXS/SHELXL-13 refinement.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2019 · Two-dimensional π-conjugated metal-organic framework with high electrical conductivity for electrochemical sensing

activated Cu3(HHTP)2 powder · Powder · PXRD collected with Rigaku Ultima IV diffractometer; Figure 1d reports pattern and structural inset.

Diffraction StructurePowder

powder X-ray diffraction, Co Kalpha radiation

2018 · A coronene-based semiconducting two-dimensional metal-organic framework with ferromagnetic behavior

black polycrystalline PTC-Fe 2D MOF powder/crystals · Powder · Room-temperature PXRD compared with DFT-simulated stacking arrangements.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2018 · A new semiconducting coordination polymer consisting of copper(I)-iodide and 3-pyridinecarboxaldehyde

Yellow needle-shaped single crystals of 1 · Single Crystal · Rigaku R-AXIS RAPID imaging plate detector; graphite-monochromated Mo-Kalpha radiation; 44 oscillation images; numerical absorption correction; solved by direct methods and refined with SHELXL97.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Panalytical X'pert PRO

2018 · A Water-Stable Proton-Conductive Barium(II)-Organic Framework for Ammonia Sensing at High Humidity

Water- and pH-treated MOF 1 solids · Powder · As-synthesised, simulated, water-treated, pH-treated, post-impedance, and post-NH3-sensing solids compared.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2018 · Bioinspired fiber-like porous Cu/N/C electrocatalyst facilitating electron transportation toward oxygen reaction for metal-air batteries

Cu-MOF · Powder · Cu-Ka radiation; Rigaku 3014 according to SI.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2018 · Bioinspired fiber-like porous Cu/N/C electrocatalyst facilitating electron transportation toward oxygen reaction for metal-air batteries

Cu/C · Powder · XRD after calcination and acid leaching.

Diffraction StructureUnspecified subtype

X-ray diffraction (XRD)

2018 · Bioinspired fiber-like porous Cu/N/C electrocatalyst facilitating electron transportation toward oxygen reaction for metal-air batteries

CuNC (MOF) · Powder · XRD after calcination and acid leaching.

Diffraction StructurePowder

Powder XRD

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

Ni-Fe-O · Powder · Phase identification of no-Se oxide control.

Diffraction StructurePowder

Powder XRD

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

NiFe-PBA · Powder · XRD scan rate 10° min-1; phase identification of NiFe-PBA.

SpectroscopyUnspecified subtype

Post-OER XRD/XPS

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

Ni-Fe-Se1:1-180 · Powder · Stability-test structural and surface analysis; supporting plots in missing Figs. S11-S12.

Diffraction StructurePowder

Powder XRD and FT-IR

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

Ni-Fe-Se1:3-180 · Powder · NiFe-PBA:Se mass-ratio variant 1:3; detailed plots in rendered SI.

Diffraction StructurePowder

Powder XRD and FT-IR

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

Ni-Fe-Se3:1-180 · Powder · NiFe-PBA:Se mass-ratio variant 3:1; detailed plots in rendered SI.

Diffraction StructurePowder

Powder XRD

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

Ni-Fe-Se1:1-180 · Powder · Phase identification after selenization.

Diffraction StructurePowder

Powder XRD and FT-IR

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

Ni-Fe-Se1:1-140 · Powder · Temperature-variant structural comparison at 140 °C; detailed plots in rendered SI.

Diffraction StructurePowder

Powder XRD and FT-IR

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

Ni-Fe-Se1:1-160 · Powder · Temperature-variant structural comparison at 160 °C; detailed plots in rendered SI.

Diffraction StructurePowder

Powder XRD and FT-IR

2018 · Composition-dependent electrocatalytic activities of NiFe-based selenides for the oxygen evolution reaction

Ni-Fe-Se1:1-200 · Powder · Temperature-variant structural comparison at 200 °C; detailed plots in rendered SI.

Diffraction StructurePowder

powder X-ray diffraction

2018 · Conductive Metal-Organic Frameworks as Ion-to-Electron Transducers in Potentiometric Sensors

GCE/M3HHTP2 MOF film series · Electrode · Bruker D8 diffractometer, Cu Kalpha radiation, compared with simulated slipped parallel packing.

Diffraction StructurePowder

powder XRD with Cu Kalpha radiation

2018 · Construction of hierarchical nickel cobalt selenide complex hollow spheres for pseudocapacitors with enhanced performance

NiCo2O4 MHSs · Powder · Rigaku D/max-UItimaIII, lambda = 0.15418 nm

Diffraction StructurePowder

powder XRD with Cu Kalpha radiation

2018 · Construction of hierarchical nickel cobalt selenide complex hollow spheres for pseudocapacitors with enhanced performance

hierarchical (Ni0.33Co0.67)Se2 CHSs · Powder · Rigaku D/max-UItimaIII, lambda = 0.15418 nm

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2018 · Development of a UiO-Type Thin Film Electrocatalysis Platform with Redox-Active Linkers

Zr(dcphOH-NDI) bulk microcrystalline powder · Powder · Bulk powder PXRD compared to simulated UiO/PIZOF Zr-L6 pattern; stability checks after DMF, H2O, air, N2 sorption, and titration.

Diffraction StructurePowderGrazing incidence

Grazing-incidence PXRD, SEM, and XPS

2018 · Development of a UiO-Type Thin Film Electrocatalysis Platform with Redox-Active Linkers

Zr(dcphOH-NDI)@FTO thin film · Thin Film · Thin film on FTO characterised by PXRD, SEM, XPS Zr 3d/N 1s/C 1s; XPS used Al K-alpha radiation and C 1s correction.

Microscopy MorphologyUnspecified subtype

SEM, TEM, XRD

2018 · Electrochemical properties of uniquely structured Fe2O3 and FeSe2/graphitic-carbon microrods synthesized by applying a metal-organic framework

D-Fe2O3-NSA microrods · Powder · D-Fe2O3-NSA comparison after oxidation at 350 deg C

Microscopy MorphologyUnspecified subtype

SEM, TEM, XRD, Raman spectroscopy

2018 · Electrochemical properties of uniquely structured Fe2O3 and FeSe2/graphitic-carbon microrods synthesized by applying a metal-organic framework

D-FeSe2/C microrods · Powder · Dense FeSe2/C comparison sample prepared by direct selenization of MIL-88

Microscopy MorphologyUnspecified subtype

SEM, TEM, HR-TEM, SAED, elemental mapping, XRD

2018 · Electrochemical properties of uniquely structured Fe2O3 and FeSe2/graphitic-carbon microrods synthesized by applying a metal-organic framework

Fe@GC microrods · Powder · Fe@GC microrods after reduction at 450 deg C under H2/Ar

Diffraction StructureUnspecified subtype

SEM, TEM, HR-TEM, SAED, elemental mapping, XRD

2018 · Electrochemical properties of uniquely structured Fe2O3 and FeSe2/graphitic-carbon microrods synthesized by applying a metal-organic framework

H-Fe2O3-NSA microrods · Powder · H-Fe2O3-NSA after oxidation of Fe@GC at 300 deg C in air

Diffraction StructureUnspecified subtype

SEM, TEM, HR-TEM, SAED, elemental mapping, XRD

2018 · Electrochemical properties of uniquely structured Fe2O3 and FeSe2/graphitic-carbon microrods synthesized by applying a metal-organic framework

H-FeSe2/GC microrods · Powder · H-FeSe2/GC after selenization of Fe@GC at 250 deg C under H2/Ar

Diffraction StructureUnspecified subtype

SEM, TEM, XRD, N2 BET

2018 · Electrochemical properties of uniquely structured Fe2O3 and FeSe2/graphitic-carbon microrods synthesized by applying a metal-organic framework

MIL-88 microrods · Powder · MIL-88 precursor morphology, phase, and surface area; XRD and BET details primarily in SI figures referenced from main text

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2018 · High electrical conductivity and high porosity in a Guest@MOF material: Evidence of TCNQ ordering within Cu3BTC2 micropores

VPI xTCNQ@Cu3BTC2 concentration series · Powder · 2theta range 5-50 degrees, step 0.0016413 degrees, PANalytical Empyrean with Cu X-ray tube operated at 45 kV and 40 mA; samples in 0.7 mm borosilicate capillaries.

Diffraction StructurePowder

1H NMR and powder X-ray diffraction (PXRD)

2018 · High Proton Mobility with High Directionality in Isolated Channels of MOF-74

pH 11 NH4OH-treated Co-MOF-74 crystals before electrode configuration · Single Crystal · Co-MOF-74 crystals after pH 11 treatment, compared with as-synthesised Co-MOF-74.

Diffraction StructurePowder

1H NMR and powder X-ray diffraction (PXRD)

2018 · High Proton Mobility with High Directionality in Isolated Channels of MOF-74

pH 3 H2SO4-treated Co-MOF-74 crystals before electrode configuration · Single Crystal · Co-MOF-74 crystals after pH 3 treatment, compared with as-synthesised Co-MOF-74.

Diffraction StructurePowder

1H NMR and powder X-ray diffraction (PXRD)

2018 · High Proton Mobility with High Directionality in Isolated Channels of MOF-74

pH 5 H2SO4-treated Co-MOF-74 crystals before electrode configuration · Single Crystal · Co-MOF-74 crystals after pH 5 treatment, compared with as-synthesised Co-MOF-74.

Diffraction StructurePowder

1H NMR and powder X-ray diffraction (PXRD)

2018 · High Proton Mobility with High Directionality in Isolated Channels of MOF-74

pH 7 H2O-coordinating Co-MOF-74 crystals before electrode configuration · Single Crystal · Co-MOF-74 crystals after pH 7 treatment, compared with as-synthesised Co-MOF-74.

Diffraction StructurePowder

1H NMR and powder X-ray diffraction (PXRD)

2018 · High Proton Mobility with High Directionality in Isolated Channels of MOF-74

pH 9 NH4OH-treated Co-MOF-74 crystals before electrode configuration · Single Crystal · Co-MOF-74 crystals after pH 9 treatment, compared with as-synthesised Co-MOF-74.

SpectroscopyPowder

XPS and PXRD before/after chemical reduction

2018 · Highly Conducting Neutral Coordination Polymer with Infinite Two-Dimensional Silver-Sulfur Networks

reduced Ag-BHT pellet · Pellet · XPS S 2p, Ag 3d, Li 1s and PXRD patterns compared between pristine and reduced Ag-BHT.

Diffraction StructureUnspecified subtype

out-of-plane XRD

2018 · Highly Conductive 2D Metal-Organic Framework Thin Film Fabricated by Liquid-Liquid Interfacial Reaction Using One-Pot-Synthesized Benzenehexathiol

Ag3BHT2 thin film · Thin Film · Rigaku TTRAX3 X-ray diffraction analyser, 15 kW, lambda = 1.541 A, 2theta = 5 to 35 deg.

Diffraction StructureUnspecified subtype

out-of-plane XRD

2018 · Highly Conductive 2D Metal-Organic Framework Thin Film Fabricated by Liquid-Liquid Interfacial Reaction Using One-Pot-Synthesized Benzenehexathiol

Au3BHT2 thin film · Thin Film · Rigaku TTRAX3 X-ray diffraction analyser, 15 kW, lambda = 1.541 A, 2theta = 5 to 35 deg.

Diffraction StructureUnspecified subtype

XRD

2018 · Highly Conductive 2D Metal-Organic Framework Thin Film Fabricated by Liquid-Liquid Interfacial Reaction Using One-Pot-Synthesized Benzenehexathiol

Ag3BHT2 powder-pressed thick film · Pellet · Thick-film XRD shown in SI Figure S2.

Diffraction StructureUnspecified subtype

XRD

2018 · In situ growth of ultrathin Co-MOF nanosheets on Α-Fe2O3 hematite nanorods for efficient photoelectrochemical water oxidation

Fe2O3@Co-MOF varied Co/MIm ratio series · Electrode · XRD of FTO-supported hematite and Co-MOF-modified hematite film series using Cu Kalpha radiation.

Diffraction StructureUnspecified subtype

XRD

2018 · In situ growth of ultrathin Co-MOF nanosheets on Α-Fe2O3 hematite nanorods for efficient photoelectrochemical water oxidation

Co-MOF powder / pristine ZIF-67 reference · Powder · XRD of Co-MOF powder particles.

Diffraction StructurePowder

PXRD and SEM

2018 · Increased Electrical Conductivity in a Mesoporous Metal-Organic Framework Featuring Metallacarboranes Guests

NiCB@NU-1000 powder · Powder · Powder XRD patterns compared with simulated NU-1000; SEM image of NiCB@NU-1000.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2018 · Increased Electrical Conductivity in a Mesoporous Metal-Organic Framework Featuring Metallacarboranes Guests

NiCB@SC-NU-1000 single crystal · Single Crystal · One crystal mounted in paratone oil and measured at 100 K with Mo Kalpha radiation; SQUEEZE used for disordered solvent.

Diffraction StructureGrazing incidence

Grazing-incidence wide-angle X-ray scattering (GIWAXS) and XRD comparison

2018 · Mithrene is a self-assembling robustly blue luminescent metal-organic chalcogenolate assembly for 2d optoelectronic applications

Mithrene concentration and growth-time screening samples · Thin Film · ALS beamline 7.3.3; 10 keV beamline energy, 1.24 Angstrom wavelength, 0.5 mm beam, 280 mm sample-detector distance, helium atmosphere, silver behenate calibration, Ewald corrections with Xi-cam I.

Diffraction StructurePowder

Calculated/theoretical powder XRD reference patterns

2018 · Mithrene is a self-assembling robustly blue luminescent metal-organic chalcogenolate assembly for 2d optoelectronic applications

Bulked mithrene powder from about 50 reactions · Powder · Calculated powder XRD patterns adjusted to monochromatic 1.24 Angstrom synchrotron wavelength, with 2theta and q axes.

Diffraction StructurePowder

Powder X-ray diffraction

2018 · Modular O2 electroreduction activity in triphenylene-based metal-organic frameworks

Cu3(HHTP)2 MOF powder · Powder · PXRD patterns for hexagonal and trigonal HHTP MOFs; 2 mm and 8 mm slits, scan rate 0.02 degrees/s, dwell 0.2 s/step.

Diffraction StructurePowder

Powder X-ray diffraction

2018 · Modular O2 electroreduction activity in triphenylene-based metal-organic frameworks

Ni3(HITP)2 MOF powder · Powder · PXRD patterns compared with simulated/reference patterns for the hexagonal phase.

Diffraction StructureUnspecified subtype

XRD

2018 · Nanostructured CuO/C Hollow Shell@3D Copper Dendrites as a Highly Efficient Electrocatalyst for Oxygen Evolution Reaction

as-prepared Cu2O-Cu NDs electrode · Electrode · X-ray diffraction of as-prepared Cu2O-Cu nanodendrites.

Diffraction StructureUnspecified subtype

SEM, TEM, XRD, STEM-EDX

2018 · Nanostructured CuO/C Hollow Shell@3D Copper Dendrites as a Highly Efficient Electrocatalyst for Oxygen Evolution Reaction

MOFs coated NDs · Electrode · Structure and composition of HKUST-1 MOF-coated nanodendrites.

Diffraction StructureUnspecified subtype

XRD and SAED

2018 · Nanostructured CuO/C Hollow Shell@3D Copper Dendrites as a Highly Efficient Electrocatalyst for Oxygen Evolution Reaction

HS-CuO/C NDs electrode · Electrode · Phase analysis of annealed ND samples and inside-out selected area electron diffraction on HS-CuO/C NDs.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction with Mo Kalpha radiation on Bruker-AXS X8 Kappa Duo / Smart APEX II CCD

2018 · Novel Topology in Semiconducting Tetrathiafulvalene Lanthanide Metal-Organic Frameworks

diffraction-quality Tm6(TTFTB)5 red rhombic crystals · Single Crystal · Solvated single crystal mounted in Paratone oil on Kapton loop; low-temperature data at 100 K; solved with SHELXT and refined with SHELXL-2016; SQUEEZE/PLATON used for residual electron density.

Diffraction StructurePowderRefinement

variable-pressure powder X-ray diffraction with Rietveld analysis

2018 · Probing charge transfer characteristics in a donor-acceptor metal-organic framework by Raman spectroelectrochemistry and pressure-dependence studies

[(Zn(DMF))2(TTFTC)(DPNI)] powder in DAC for variable-pressure PXRD · Powder · APS 17-BM-B Rapid Acquisition Powder Diffraction beamline; lambda = 0.45212 A; DAC with Fluorinert FC-70; NaCl internal pressure standard.

Diffraction StructurePowder

PXRD before and after electrolysis

2018 · Probing charge transfer characteristics in a donor-acceptor metal-organic framework by Raman spectroelectrochemistry and pressure-dependence studies

[(Zn(DMF))2(TTFTC)(DPNI)] powder on DS-150 screen-printed electrode · Electrode · PXRD patterns collected before electrolysis and after electrolysis to assess framework stability after electrochemical treatment.

Diffraction StructurePowder

powder X-ray diffraction

2018 · Probing charge transfer characteristics in a donor-acceptor metal-organic framework by Raman spectroelectrochemistry and pressure-dependence studies

bulk powder [(Zn(DMF))2(TTFTC)(DPNI)] · Powder · PANalytical X'Pert Pro; Cu-Kalpha radiation, lambda = 1.5406 A; powder on Si reflective disc.

Diffraction StructurePowder

Powder X-ray diffraction

2018 · Quantum Effects Allow the Construction of Two-Dimensional Co3O4-Embedded Nitrogen-Doped Porous Carbon Nanosheet Arrays from Bimetallic MOFs as Bifunctional Oxygen Electrocatalysts

Co3O4-NC-n-m series · Powder · XRD patterns of ZnCo-ZIF-derived products calcined at 900 C.

Diffraction StructurePowder

Powder X-ray diffraction (Cu Kalpha, Bruker D8 ADVANCE)

2018 · Quantum Effects Allow the Construction of Two-Dimensional Co3O4-Embedded Nitrogen-Doped Porous Carbon Nanosheet Arrays from Bimetallic MOFs as Bifunctional Oxygen Electrocatalysts

ZnCo-ZIF-15 precursor · Powder · XRD patterns of ZnCo-ZIF-5, ZnCo-ZIF-10, and ZnCo-ZIF-15 precursors; measurement row anchored to ZnCo-ZIF-15 series endpoint.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction using Bruker AXS APEX CCD with graphite-monochromated Mo Kalpha radiation; SHELXS-97/SHELXL-97 refinement.

2018 · Semiconducting lanthanide polymers of pyridine-2,6-dicarboxylate: Hydrothermal synthesis, structural characterization, electrical conductivity and luminescence properties

compound 1 colourless crystals · Single Crystal · 296(2) K; wavelength 0.71073 A; absorption corrected; full-sphere data collection.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction using Bruker AXS APEX CCD with graphite-monochromated Mo Kalpha radiation; SHELXS-97/SHELXL-97 refinement.

2018 · Semiconducting lanthanide polymers of pyridine-2,6-dicarboxylate: Hydrothermal synthesis, structural characterization, electrical conductivity and luminescence properties

compound 2 violet crystals · Single Crystal · 296(2) K; wavelength 0.71073 A; absorption corrected; full-sphere data collection.

Diffraction StructurePowder

PXRD and N2 sorption after chemical/electrolyte exposure

2018 · Stabilization of Hexaaminobenzene in a 2D Conductive Metal-Organic Framework for High Power Sodium Storage

Co-HAB-D optimised mixed-solvent product · Powder · Chemical stability in H2O, 0.1 M HCl, saturated 12 M NH4OH and 0.1 M KOH; electrolyte soaking in LiPF6 EC/DEC and NaPF6 DEGDME for 24 h at RT; PXRD and N2 sorption checked after washing/activation.

Diffraction StructurePowderRefinement

Synchrotron PXRD and Pawley profile fitting

2018 · Stabilization of Hexaaminobenzene in a 2D Conductive Metal-Organic Framework for High Power Sodium Storage

Co-HAB-D optimised mixed-solvent product · Powder · Synchrotron PXRD at 17-BM, Advanced Photon Source; lambda = 0.45212 A; hexagonal cell refinement.

Diffraction StructurePowder

PXRD and N2 sorption after thermal treatment

2018 · Stabilization of Hexaaminobenzene in a 2D Conductive Metal-Organic Framework for High Power Sodium Storage

Co-HAB-D optimised mixed-solvent product · Powder · As-synthesised samples degassed on Autosorb IQ2 for 2 h at 80, 150, 200, 250 and 300 C; N2 sorption at 77 K and PXRD used to confirm crystallinity.

Diffraction StructureGrazing incidence

GIXRD

2018 · Surface Morphology and Electrical Properties of Cu3BTC2 Thin Films before and after Reaction with TCNQ

Cu(TCNQ) film from 20-cycle Cu3BTC2 on ITO · Thin Film · 2theta 5-30 degrees; PANalytical Empyrean with Cu X-ray tube at 44 kV and 40 mA.

Diffraction StructureGrazing incidence

GIXRD

2018 · Surface Morphology and Electrical Properties of Cu3BTC2 Thin Films before and after Reaction with TCNQ

PCN-14 film after TCNQ/MeOH infiltration · Thin Film · PCN-14 film before and after TCNQ/MeOH infiltration; compared with PCN-14 and Cu(TCNQ) references.

Diffraction StructurePowder

PXRD

2018 · Surface Morphology and Electrical Properties of Cu3BTC2 Thin Films before and after Reaction with TCNQ

Cu3BTC2 powder after 7 days TCNQ/MeOH · Powder · Powder patterns recorded in capillary mode after TCNQ/MeOH infiltration for 3 and 7 days.

Diffraction StructureGrazing incidence

GIXRD

2018 · Surface Morphology and Electrical Properties of Cu3BTC2 Thin Films before and after Reaction with TCNQ

Cu(TCNQ) film from 50-cycle Cu3BTC2 device · Electrode · 50-cycle Cu3BTC2 film on SiO2/Si(001) before and after TCNQ/MeOH infiltration.

Diffraction StructurePowder

Powder X-ray diffraction

2018 · Synthesis of a Cd(ii) based 1D coordination polymer by: In situ ligand generation and fabrication of a photosensitive electronic device

Yellow needle crystals / bulk compound 1 · Single Crystal · Bulk sample at room temperature; Bruker D8 Advance; Cu Kalpha radiation; 2theta range 5-50.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction using Bruker SMART APEX II with graphite-monochromated Mo Kalpha radiation

2018 · Synthesis of a Cd(ii) based 1D coordination polymer by: In situ ligand generation and fabrication of a photosensitive electronic device

Yellow needle crystals / bulk compound 1 · Single Crystal · Suitable single crystal; Mo Kalpha radiation lambda = 0.71073 A; structure solved/refined with SHELX packages; SI Table S1/S2 and CIF available.

Diffraction StructurePowderRefinement

Synchrotron PXRD with Rietveld refinement

2018 · Synthetic Routes for a 2D Semiconductive Copper Hexahydroxybenzene Metal-Organic Framework

Cu-HHB H2O 60 C post-treated powder · Powder · Data collected at beamline 17-BM, Advanced Photon Source; wavelength 0.45236 A; TOPAS Academic V4.1 refinement with modified Thompson-Cox-Hastings pseudo-Voigt profile and Cu-O soft restraints.

Diffraction StructurePowder

Synchrotron PXRD

2018 · Synthetic Routes for a 2D Semiconductive Copper Hexahydroxybenzene Metal-Organic Framework

Cu-THQ H2O 60 C post-treated powder · Powder · Synchrotron PXRD at beamline 17-BM, Advanced Photon Source; wavelength 0.45236 A.

Diffraction StructureGrazing incidence

GIWAXS on ultrathin glass-supported films

2018 · Tarnishing Silver Metal into Mithrene

[AgSePh]inf thin films on glass coverslips · Thin Film · GIWAXS spectra of 4, 8, 12, and 20 layer [AgSePh]inf films on glass; basal-plane reflections resolved

Diffraction StructureGrazing incidence

GIWAXS linecuts and 2D GIWAXS images

2018 · Tarnishing Silver Metal into Mithrene

[AgSePh]inf progression films from 200 nm Ag · Thin Film · GIWAXS progression of [AgSePh]inf tarnishing reaction over 1, 3, and 7/8 days; basal-plane reflections and residual metallic silver tracked

Diffraction StructureGrazing incidence

Synchrotron grazing-incidence wide-angle X-ray scattering (GIWAXS)

2018 · Tarnishing Silver Metal into Mithrene

Tarnished [AgSePh]inf thin film on silver · Thin Film · Beamline 7.3.3, 10 keV photon energy, wavelength 0.12398 nm, 0.15 deg incident angle, ca. 300 mm sample-detector distance, Pilatus 2-M detector; compared tarnished film, bulk powder, and calculated reference pattern

Diffraction StructurePowder

PXRD and TGA

2018 · Two isostructural linear coordination polymers: The size of the metal ion impacts the electrical conductivity

compound 2 as-synthesised colourless prism crystals/bulk sample · Single Crystal · PXRD at room temperature; TGA 30-600 deg C under nitrogen.

Diffraction StructurePowder

PXRD and TGA

2018 · Two isostructural linear coordination polymers: The size of the metal ion impacts the electrical conductivity

compound 1 as-synthesised colourless prism crystals/bulk sample · Single Crystal · PXRD at room temperature; TGA 30-600 deg C under nitrogen.

Diffraction StructurePowder

powder X-ray diffraction

2017 · 2D Conductive Iron-Quinoid Magnets Ordering up to Tc = 105 K via Heterogenous Redox Chemistry

compound 1a desolvated activated framework · Powder · PXRD for 1, 1a and 2 at ambient temperature or synchrotron high-resolution conditions; SI Figure S1 compares 1, 1a, 2 and simulated 2.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2017 · 2D Conductive Iron-Quinoid Magnets Ordering up to Tc = 105 K via Heterogenous Redox Chemistry

compound 2 black crystals · Single Crystal · 100 K, Bruker APEX II diffractometer, Cu Kalpha microsource; OLEX2 solvent masking used for disordered Cp2Co+ and DMF

Diffraction StructurePowder

powder XRD with Cu Kalpha radiation

2017 · 2D MOF nanoflake-assembled spherical microstructures for enhanced supercapacitor and electrocatalysis performances

Ni/Co-MOF nanoflakes · Nanosheet · XRD comparison of Ni/Co-MOF nanoflakes, Ni-MOF nanoflakes, ZIF-67 and simulated ZIF-67.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2017 · A stable porphyrinic metal-organic framework pore-functionalized by high-density carboxylic groups for proton conduction

BUT-83 after boiling-water and concentrated-HCl treatments · Powder · PXRD compared as-synthesised, simulated, boiling-water-treated and concentrated-HCl-treated samples.

Diffraction StructurePowder

Powder X-ray diffraction

2017 · A stable porphyrinic metal-organic framework pore-functionalized by high-density carboxylic groups for proton conduction

Co(DpyDtolP) powder · Powder · PXRD pattern of Co(DpyDtolP) compared with simulated pattern.

Diffraction StructurePowder

powder X-ray diffraction

2017 · Carbon-incorporated Janus-type Ni2P/Ni hollow spheres for high performance hybrid supercapacitors

NP-150 · Powder · Cu Kalpha radiation, 2theta 10-80 deg, scan speed 5 deg min-1; XRD compared Ni-MOFs, N-0 and NP-series samples.

Diffraction StructurePowder

Powder X-ray diffraction; Crysfire indexing

2017 · Colossal Increase in Electric Current and High Rectification Ratio in a Photoconducting, Self-Cleaning, and Luminescent Schottky Barrier NMOF Diode

NMOF-1 bulk nanosheets/powder · Nanosheet · Cu-Kalpha PXRD indexed as orthorhombic; compared to model

Diffraction StructurePowder

Powder X-ray diffraction

2017 · Conductive Metal–Organic Framework Nanowire Array Electrodes for High-Performance Solid-State Supercapacitors

Cu-CAT nanowire arrays on carbon fibre paper · Electrode · PXRD using Cu K alpha; Cu-CAT NWAs on carbon paper compared with Cu-CAT powder and simulated Cu-CAT.

Diffraction StructurePowder

PXRD and FTIR

2017 · Controllable proton-conducting pathways: Via situating polyoxometalates in targeting pores of a metal-organic framework

3 · Powder · PXRD measured with Cu Kalpha radiation over 2theta = 3-15 degrees at 293 K; FTIR measured from 400-4000 cm^-1 using KBr pellets.

Diffraction StructurePowder

PXRD and FTIR

2017 · Controllable proton-conducting pathways: Via situating polyoxometalates in targeting pores of a metal-organic framework

TETA@3 · Powder · PXRD and FTIR used to verify polyamine modification and host stability.

Diffraction StructurePowder

SEM and powder XRD of Co-MOF precursor

2017 · CoP nanoparticles embedded in P and N co-doped carbon as efficient bifunctional electrocatalyst for water splitting

As-synthesised Co-MOF precursor · Powder · Supporting Figure S1 shows SEM image and XRD pattern of Co-MOFs.

Diffraction StructureUnspecified subtype

X-ray diffraction using Bruker D8 Advance with Lynxeye detector in theta-2theta geometry and Cu Kalpha radiation

2017 · Defects as Color Centers: The Apparent Color of Metal-Organic Frameworks Containing Cu2+-Based Paddle-Wheel Units

conventional low-quality HKUST-1 SURMOF · Thin Film · HKUST-1 SURMOFs grown on quartz glass; black curve is low-quality sample, red curve is high-quality sample, grey curve is calculated HKUST-1 powder diffractogram.

Diffraction StructurePowder

powder X-ray diffraction

2017 · Drawing sensors with ball-milled blends of metal-organic frameworks and graphite

Co3HHTP2/graphite blended pellet · Pellet · scaled pXRD spectra for graphite, M3HHTP2 and M3HHTP2/graphite blend bulk

Diffraction StructurePowder

powder X-ray diffraction

2017 · Drawing sensors with ball-milled blends of metal-organic frameworks and graphite

pure Co3HHTP2 powder · Powder · powder pattern compared with reported analysis and simulated configurations for Fe3HHTP2

Diffraction StructurePowder

powder X-ray diffraction

2017 · Drawing sensors with ball-milled blends of metal-organic frameworks and graphite

Cu3HHTP2/graphite blended pellet · Pellet · scaled pXRD spectra for graphite, M3HHTP2 and M3HHTP2/graphite blend bulk

Diffraction StructurePowder

powder X-ray diffraction

2017 · Drawing sensors with ball-milled blends of metal-organic frameworks and graphite

pure Cu3HHTP2 powder · Powder · powder pattern compared with reported analysis and simulated configurations for Fe3HHTP2

Diffraction StructurePowder

powder X-ray diffraction

2017 · Drawing sensors with ball-milled blends of metal-organic frameworks and graphite

Fe3HHTP2/graphite blended pellet · Pellet · scaled pXRD spectra for graphite, M3HHTP2 and M3HHTP2/graphite blend bulk

Diffraction StructurePowder

powder X-ray diffraction

2017 · Drawing sensors with ball-milled blends of metal-organic frameworks and graphite

pure Fe3HHTP2 powder · Powder · powder pattern compared with reported analysis and simulated configurations for Fe3HHTP2

Diffraction StructurePowder

powder X-ray diffraction

2017 · Drawing sensors with ball-milled blends of metal-organic frameworks and graphite

Ni3HHTP2/graphite blended pellet · Pellet · scaled pXRD spectra for graphite, M3HHTP2 and M3HHTP2/graphite blend bulk

Diffraction StructurePowder

powder X-ray diffraction

2017 · Drawing sensors with ball-milled blends of metal-organic frameworks and graphite

pure Ni3HHTP2 powder · Powder · powder pattern compared with reported analysis and simulated configurations for Fe3HHTP2

Diffraction StructurePowder

PXRD after acid/base soaking

2017 · Efficient and Selective Uptake of TcO4- by a Cationic Metal-Organic Framework Material with Open Ag+ Sites

pH-treated SCU-100 · Powder · SCU-100 soaked in HNO3 or NaOH solutions with pH 1-13 for 12 h; PXRD and subsequent ReO4- sorption checked.

Diffraction StructurePowder

powder X-ray diffraction

2017 · Efficient and Selective Uptake of TcO4- by a Cationic Metal-Organic Framework Material with Open Ag+ Sites

SCU-100 crystals · Single Crystal · PXRD collected from 5 to 50 degrees 2theta with 0.02 degree step using Cu Kalpha radiation.

Diffraction StructurePowder

PXRD after beta/gamma irradiation

2017 · Efficient and Selective Uptake of TcO4- by a Cationic Metal-Organic Framework Material with Open Ag+ Sites

beta/gamma irradiated SCU-100 · Powder · Beta irradiation: 1.2 MeV electron beams, 20 kGy/h, 80 and 200 kGy. Gamma irradiation: 60Co source, 1.2 kGy/h, 100 and 200 kGy.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2017 · Efficient and Selective Uptake of TcO4- by a Cationic Metal-Organic Framework Material with Open Ag+ Sites

ReO4- sorbed SCU-100 crystals · Single Crystal · SCU-100-Re single crystals analysed after ReO4- exchange; structure refined and compared to pristine SCU-100.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2017 · Efficient and Selective Uptake of TcO4- by a Cationic Metal-Organic Framework Material with Open Ag+ Sites

SCU-100 crystals · Single Crystal · Bruker D8-Venture, Mo-Kalpha radiation, room temperature; structures solved by direct methods and refined with SHELXTL-97.

Diffraction StructureUnspecified subtype

XRD and XPS

2017 · Efficient hydrogen production from MIL-53(Fe) catalyst-modified Mo: BiVO4 photoelectrodes

FMBV-2 / 2% Mo:BiVO4-MIL-53(Fe) · Electrode · FMBV-2 and pure 2% Mo:BiVO4 compared; XPS elemental spectra for FMBV.

Diffraction StructurePowder

Powder XRD

2017 · Efficient hydrogen production from MIL-53(Fe) catalyst-modified Mo: BiVO4 photoelectrodes

as-prepared MIL-53(Fe) powder · Powder · Cu Kalpha radiation, 40 kV and 40 mA.

Diffraction StructurePowder

PXRD after water immersion

2017 · Electrochemical synthesis of metal organic framework films with proton conductive property

as-prepared NENU-3 films on copper · Thin Film · NENU-3 film soaked in water at room temperature for 3 days; HKUST-1 comparison immersed in water for 30 min.

Diffraction StructurePowder

PXRD

2017 · Electrochemical synthesis of metal organic framework films with proton conductive property

as-prepared NENU-3 films on copper · Thin Film · NENU-3 films prepared for 0.5, 1 and 8 h at 2.0 V compared with simulated pattern.

Diffraction StructurePowder

Powder X-ray diffraction (XRD), Cu K-alpha radiation

2017 · Fabrication of Hierarchical Porous Metal-Organic Framework Electrode for Aqueous Asymmetric Supercapacitor

HP-UiO-66 powder · Powder · D8 Advance, Bruker; 40 kV and 40 mA; compared with bare UiO-66, Zn/Zr MOFs and simulated patterns.

Diffraction StructurePowder

Powder X-ray diffraction

2017 · Fluorescent metal-organic frameworks for selective sensing of toxic cations (Tl3+, Hg2+) and highly oxidizing anions ((CrO4)2−, (Cr2O7)2−, (MnO4)−)

compound I yellow platelike crystals · Single Crystal · PXRD recorded over 2theta 5-50 degrees using Cu Kalpha radiation.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; Mo Kalpha radiation; SHELX refinement

2017 · Fluorescent metal-organic frameworks for selective sensing of toxic cations (Tl3+, Hg2+) and highly oxidizing anions ((CrO4)2−, (Cr2O7)2−, (MnO4)−)

compound I yellow platelike crystals · Single Crystal · Data collected at 120 K on Oxford Xcalibur diffractometer; final refinement parameters reported in Table 1.

Diffraction StructurePowder

Powder X-ray diffraction

2017 · Fluorescent metal-organic frameworks for selective sensing of toxic cations (Tl3+, Hg2+) and highly oxidizing anions ((CrO4)2−, (Cr2O7)2−, (MnO4)−)

compound II yellow needlelike crystals · Single Crystal · PXRD recorded over 2theta 5-50 degrees using Cu Kalpha radiation.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; Mo Kalpha radiation; SHELX refinement

2017 · Fluorescent metal-organic frameworks for selective sensing of toxic cations (Tl3+, Hg2+) and highly oxidizing anions ((CrO4)2−, (Cr2O7)2−, (MnO4)−)

compound II yellow needlelike crystals · Single Crystal · Data collected at 120 K on Oxford Xcalibur diffractometer; final refinement parameters reported in Table 1.

Diffraction StructurePowder

Powder X-ray diffraction using CuKa radiation

2017 · From zinc-cyanide hybrid coordination polymers to hierarchical yolk-shell structures for high-performance and ultra-stable lithium-ion batteries

monodispersed ZnCP microspheres · Powder · Phase assignment of ZnCP microspheres.

Diffraction StructurePowder

Powder XRD

2017 · From zinc-cyanide hybrid coordination polymers to hierarchical yolk-shell structures for high-performance and ultra-stable lithium-ion batteries

YC-ZnO microspheres · Powder · Phase assignment of derived ZnO and YC-ZnO; main text reports the interpretation and rendered SI Fig. S1 was visually checked.

Diffraction StructurePowder

PXRD

2017 · Giant Enhancement of Carrier Mobility in Bimetallic Coordination Polymers

Fe-BTC-Cr 1:1 xerogel pressed pellet · Pellet · PXRD patterns recorded from 2 theta = 5 to 40 degrees at room temperature.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SC-XRD)

2017 · Hybrid metal-organic chalcogenide nanowires with electrically conductive inorganic core through diamondoid-directed assembly

As-synthesised 1ADCu needle-shaped crystals · Single Crystal · Crystals lifted from solvent, coated with Paratone-N oil, mounted on Kapton loop; data collected at 100 K with synchrotron radiation.

Diffraction StructurePowder

Powder X-ray diffraction

2017 · Hybrid metal-organic chalcogenide nanowires with electrically conductive inorganic core through diamondoid-directed assembly

Solvent-processed 1ADCu powder · Powder · Calculated single-crystal pattern compared with pristine and solvent-processed powders.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction (SC-XRD)

2017 · Hybrid metal-organic chalcogenide nanowires with electrically conductive inorganic core through diamondoid-directed assembly

As-synthesised 4DICu crystals · Single Crystal · Crystals mounted as above; data collected at 100 K with synchrotron radiation.

SpectroscopyPowder

XPS of Cu 2p plus PXRD of H2O2-doped 1ADCu

2017 · Hybrid metal-organic chalcogenide nanowires with electrically conductive inorganic core through diamondoid-directed assembly

H2O2-doped 1ADCu powder samples · Powder · XPS with Al Kalpha source in 1e-5 torr vacuum; PXRD with Cu Kalpha source at room temperature.

Microscopy MorphologyPowder

SEM and powder XRD

2017 · Hybrid metal-organic chalcogenide nanowires with electrically conductive inorganic core through diamondoid-directed assembly

Ag-, Cd-, Zn- and Fe-based demonstration MOC crystals · Powder · SEM micrographs of non-copper MOC crystals and PXRD patterns of silver thiolate MOCs with different SDAs.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2017 · Hydrolytically Stable Luminescent Cationic Metal Organic Framework for Highly Sensitive and Selective Sensing of Chromate Anions in Natural Water Systems

solution-treated samples of 1 for hydrolytic stability · Powder · PXRD from 5 to 50 deg, step 0.02 deg, 0.2 s collection time, Cu Kalpha radiation. Samples treated in pH media, salts, Dushu Lake water or seawater for 24 h before analysis.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; Bruker D8-Venture with Mo Kalpha radiation in main text; CIF reports Bruker apex II, MoKalpha, SHELXL-2014/7 refinement

2017 · Hydrolytically Stable Luminescent Cationic Metal Organic Framework for Highly Sensitive and Selective Sensing of Chromate Anions in Natural Water Systems

as-synthesised light yellow block crystals of 1 · Single Crystal · Data collection reported at 273 K in main text; SI table and CIF report 296(2) K. Structure solved by direct methods and refined on F2.

Diffraction StructurePowder

Powder X-ray diffraction

2017 · Intercatenated Coordination Polymers (ICPs) of Carboxylato Bridged Zn(II)-Isoniazid and Their Electrical Conductivity

Colourless block-shaped crystals of [Zn(INH)(succ)]n (1) · Single Crystal · As-synthesised PXRD patterns compared with simulated single-crystal patterns for 1-3.

Diffraction StructurePowder

SEM and PXRD before and after NH3 contact.

2017 · Layer-by-Layer Assembled Conductive Metal–Organic Framework Nanofilms for Room-Temperature Chemiresistive Sensing

Cu3(HHTP)2 powder · Powder · Cu3(HHTP)2 powders compared before and after contact with NH3.

Diffraction StructurePowder

Powder X-ray diffraction

2017 · Lowering Band Gap of an Electroactive Metal-Organic Framework via Complementary Guest Intercalation

TTF-doped DSNDI-based MOF-74 powder · Powder · PXRD profile of TTF-doped MOF-74 compared with undoped MOF-74.

Diffraction StructureUnspecified subtype

Post-cycling XRD and SEM

2017 · Mixed-metallic MOF based electrode materials for high performance hybrid supercapacitors

Co/Ni-MOF NAFLs · Nanosheet · XRD after 3000 and 5000 cycles; SEM after 5000 cycles; compared with Zn/Ni-MOF and Ni-MOF.

Diffraction StructurePowder

Powder XRD with Cu-Kalpha radiation

2017 · Mixed-metallic MOF based electrode materials for high performance hybrid supercapacitors

Co/Ni-MOF NAFLs · Nanosheet · Isostructural comparison with Ni-MOF simulated pattern.

Diffraction StructurePowder

Powder XRD with Cu-Kalpha radiation

2017 · Mixed-metallic MOF based electrode materials for high performance hybrid supercapacitors

Ni-MOF powder / NAFL control · Nanosheet · Compared with simulated pattern from [Ni3(OH)2(C8H4O4)2(H2O)4].2H2O (CCDC 638866).

Diffraction StructurePowder

Powder XRD with Cu-Kalpha radiation

2017 · Mixed-metallic MOF based electrode materials for high performance hybrid supercapacitors

Zn/Ni-MOF NAFLs · Nanosheet · Isostructural comparison with Ni-MOF simulated pattern.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2017 · Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability

Copper-luster rod-like single crystals of compound 3 · Single Crystal · Mo Kalpha radiation, 0.71073 A; Bruker APEX-II diffractometer; structure refined using SHELXL-97 in Yadokari-XG2009.

Diffraction StructureSingle crystal

temperature-dependent single-crystal X-ray diffraction

2017 · Multiple-Hydrogen-Bond Approach to Uncommon Pd(III) Oxidation State: A Pd-Br Chain with High Conductivity and Thermal Stability

Copper-luster rod-like single crystals of compound 3 · Single Crystal · Pd-Br-Pd distance tracked versus temperature and compared with compound 1.

Diffraction StructurePowder

Powder X-ray diffraction, Cu Kalpha radiation

2017 · Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks

compound 1 black shiny microcrystalline solid · Powder · Polycrystalline sample slightly ground in agate mortar, loaded in 0.5 mm glass capillary; 2theta 5-40 deg at room temperature.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Mo Kalpha radiation

2017 · Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks

compound 1 black hexagonal prismatic single crystals · Single Crystal · Crystal mounted in hydrocarbon oil and transferred to cold nitrogen stream; data collected at 120 K.

PorosityPowder

PXRD after THF exchange and evacuation

2017 · Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks

compound 1 THF-exchanged and evacuated powder · Powder · Water in channels partially exchanged with THF; sample evacuated at 100 C; PXRD compared with pristine pattern.

Diffraction StructurePowder

Powder X-ray diffraction, Cu Kalpha radiation

2017 · Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks

compound 2 black shiny microcrystalline solid · Powder · Polycrystalline sample slightly ground in agate mortar, loaded in 0.5 mm glass capillary; 2theta 5-40 deg at room temperature.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Mo Kalpha radiation

2017 · Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks

compound 2 black single crystals · Single Crystal · Crystal mounted in hydrocarbon oil and transferred to cold nitrogen stream; data collected at 120 K.

PorosityPowder

PXRD after THF exchange and evacuation

2017 · Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks

compound 2 THF-exchanged and evacuated powder · Powder · Water in channels partially exchanged with THF; sample evacuated at 100 C; PXRD compared with pristine pattern.

Diffraction StructureUnspecified subtype

X-ray diffraction

2017 · Novel Solid-State Solar Cell Based on Hole-Conducting MOF-Sensitizer Demonstrating Power Conversion Efficiency of 2.1%

Co-DAPV thin film on glass, 8 LbL cycles · Thin Film · XRD comparison of Co-DAPV bulk powder and Co-DAPV thin film.

Diffraction StructureUnspecified subtype

X-ray diffraction

2017 · Novel Solid-State Solar Cell Based on Hole-Conducting MOF-Sensitizer Demonstrating Power Conversion Efficiency of 2.1%

2000 rpm TiO2/Co-DAPV device series, 5-30 LbL cycles · Electrode · XRD of TiO2 film deposited on FTO and sensitized with Co-DAPV.

Diffraction StructurePowder

PXRD / XRD, in-plane and out-of-plane geometries

2017 · Porous field-effect transistors based on a semiconductive metal-organic framework

Free-standing Ni3(HITP)2 membrane · Thin Film · Rigaku Miniflex 600 with Cu Kalpha radiation, lambda = 1.54056 A; samples placed on zero-background silicon.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2017 · Shielding against Unfolding by Embedding Enzymes in Metal-Organic Frameworks via a de Novo Approach

CAT@ZIF-90 · Powder · CAT@ZIF-90 compared with pristine ZIF-90 and simulated ZIF-90; additional PXRD after 8 M urea exposure and after catalysis in 6 M urea.

Diffraction StructurePowder

Powder X-ray diffraction

2017 · Shielding against Unfolding by Embedding Enzymes in Metal-Organic Frameworks via a de Novo Approach

Urease@ZIF-90 · Powder · Urease@ZIF-90 compared with ZIF-90 and simulated pattern.

Diffraction StructurePowder

Powder X-ray diffraction

2017 · Synthesis and structural characterization of a Cu(II)-based 1D coordination polymer and its application in Schottky devices

as-synthesised compound 1 bulk crystals/powder · Powder · Bruker D8 Advance, Cu Kalpha radiation (lambda = 1.548 A), 40 kV and 40 mA, 5-50 degree 2theta range, room temperature.

Diffraction StructurePowderRefinement

PXRD and Rietveld refinement

2017 · Synthesis of ordered carbonaceous frameworks from organic crystals

Ni2-CPDPy · Powder · Cu Kalpha1 radiation; direct-space method and Rietveld refinement.

Diffraction StructurePowderRefinement

PXRD and Rietveld refinement

2017 · Synthesis of ordered carbonaceous frameworks from organic crystals

Ni2-CPDPy593(0) · Powder · Synchrotron PXRD; direct-space/Rietveld analysis.

Diffraction StructureUnspecified subtype

X-ray diffractometry (XPert3, PANalytical)

2017 · TCNQ-doped Cu-metal organic framework as a novel conductometric immunosensing platform for the quantification of prostate cancer antigen

48 h TCNQ-Cu3(BTC)2 SPE · Electrode · XRD patterns of Cu3(BTC)2 and TCNQ-Cu3(BTC)2 compared.

Diffraction StructureUnspecified subtype

variable-temperature out-of-plane XRD

2017 · Thermally Driven Resistive Switching in Solution-Processable Thin Films of Coordination Polymers

Ag-TCNQ thin film on SAM/Au · Thin Film · Ag-TCNQ thin film measured at 300 K, 400 K and after cooling to 300 K

Diffraction StructureUnspecified subtype

variable-temperature out-of-plane XRD

2017 · Thermally Driven Resistive Switching in Solution-Processable Thin Films of Coordination Polymers

Cu-TCNQ thin film on SAM/Au · Thin Film · Cu-TCNQ thin-film XRD at 300 K and 370 K during switching-control experiment.

Diffraction StructurePowder

powder out-of-plane X-ray diffraction (PXRD)

2017 · Thermally Driven Resistive Switching in Solution-Processable Thin Films of Coordination Polymers

Ag-TCNQ thin film on SAM/Au · Thin Film · Patterns recorded from 0th to 10th LbL cycle to follow Cu-TCNQ to Ag-TCNQ conversion

Diffraction StructureUnspecified subtype

X-ray diffraction and SAED

2017 · Ultrathin metal-organic framework array for efficient electrocatalytic water splitting

NiFe-MOF/NF ultrathin nanosheet array electrode · Electrode · Cu K-alpha XRD; SAED rings; comparison to bulk counterpart and Ni(C12H6O4)(H2O)4.

Diffraction StructurePowder

X-ray powder diffraction

2017 · Zinc terephthalates ZnC8H4O4 as anodes for lithium ion batteries

amorphous ZnTPA powder (ZnTPA-amor) · Powder · Cu Kalpha radiation, lambda = 1.54056 A, step size 0.03 deg.

Diffraction StructurePowder

X-ray powder diffraction

2017 · Zinc terephthalates ZnC8H4O4 as anodes for lithium ion batteries

well-crystalline anhydrous ZnTPA powder · Powder · Cu Kalpha radiation, lambda = 1.54056 A, step size 0.03 deg.

Diffraction StructurePowderRefinement

Powder X-ray diffraction with Pawley fitting

2016 · Coordination environments and π-conjugation in dense lithium coordination polymers

Compound 1 pale yellow plates · Single Crystal · Ground crystals; Bruker-AXS D8, Cu Kalpha, 5-60 degrees 2theta, room temperature

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2016 · Coordination environments and π-conjugation in dense lithium coordination polymers

Compound 7 red plate-like crystals · Single Crystal · Additional compound 7 crystallised in P-1; detailed in SI and CIF

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2016 · Coordination environments and π-conjugation in dense lithium coordination polymers

Anhydrous lithium formate rod-like crystals · Single Crystal · Anhydrous lithium formate structure determined in this work and included in comparator Table S4

Diffraction StructurePowder

Powder X-ray diffraction (PXRD), Rigaku D-MAX 2550

2016 · Electrical conductivity and electroluminescence of a new anthracene-based metal-organic framework with π-conjugated zigzag chains

As-synthesised bulk NNU-27 · Powder · Radiation lambda = 0.15417 nm; 2theta range 3 to 40 degrees.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction with Bruker Smart Apex II CCD, Mo Kalpha radiation; SHELXTL refinement; PLATON/SQUEEZE for guest-free refined structure

2016 · Electrical conductivity and electroluminescence of a new anthracene-based metal-organic framework with π-conjugated zigzag chains

NNU-27 single crystal for X-ray diffraction · Single Crystal · Room-temperature data collection; graphite-monochromated Mo Kalpha radiation, lambda = 0.71073 A; absorption corrections by SADABS.

Diffraction StructureGrazing incidence

Grazing incidence X-ray diffraction

2016 · Electrochemical oxygen reduction catalysed by Ni3 (hexaiminotriphenylene)2

Ni3(HITP)2 thin film on indium tin oxide electrode · Electrode · Cu K alpha, grazing incidence angle 3.6 degrees, 10 min exposure; unmodified ITO and Ni3(HITP)2 film before/after ORR.

Diffraction StructurePowder

powder X-ray diffraction (PXRD), Cu-Kalpha radiation

2016 · Facile formation of a nanostructured NiP2@C material for advanced lithium-ion battery anode using adsorption property of metal-organic framework

activated Ni-MOF-74 · Powder · as-prepared and activated Ni-MOF-74 compared with simulated pattern; 2theta range 5-50 degrees in discussion, instrument scans also described over 10-80 degrees

Diffraction StructureUnspecified subtype

ex situ XRD, SEM, TEM/HRTEM, and SAED

2016 · Facile formation of a nanostructured NiP2@C material for advanced lithium-ion battery anode using adsorption property of metal-organic framework

NiP2@C electrode after full charge · Electrode · electrodes after full discharge to 0.01 V at fourth cycle and full charge to 2.5 V at fifth cycle

Diffraction StructurePowder

SEM, PXRD, and N2 sorption/BJH porosity

2016 · Facile formation of a nanostructured NiP2@C material for advanced lithium-ion battery anode using adsorption property of metal-organic framework

as-synthesised nanostructured NiP2@C nanocomposite · Powder · as-synthesised NiP2@C powder; N2 sorption at 77 K

Diffraction StructurePowder

Powder XRD and FE-SEM

2016 · Hollow Cobalt-Based Bimetallic Sulfide Polyhedra for Efficient All-pH-Value Electrochemical and Photocatalytic Hydrogen Evolution

Zn0.30Co2.70-MOF · Powder · As-synthesised MCo-MOFs compared with Co-MOF; SEM morphology inspected.

Microscopy MorphologyPowder

SEM, TEM, EELS elemental mapping, and powder XRD

2016 · Hollow Cobalt-Based Bimetallic Sulfide Polyhedra for Efficient All-pH-Value Electrochemical and Photocatalytic Hydrogen Evolution

hollow Zn0.30Co2.70S4 · Powder · Hollow sulphide morphology, spinel phase, shell thickness, particle shell nanostructure and EELS distribution.

Diffraction StructureUnspecified subtype

XRD

2016 · In-situ Growth of Ultrathin ZIF-67 Nanosheets on Conductive Ti@TiO2/CdS Substrate for High-efficient Electrochemical Catalysis

ZIF-67 powders · Powder · Experimental powder XRD compared with simulated crystal-structure data; 2theta range 10-50 deg per SI apparatus.

Diffraction StructurePowder

powder X-ray diffraction

2016 · Measuring and Reporting Electrical Conductivity in Metal-Organic Frameworks: Cd2(TTFTB) as a Case Study

Pressed pellet, direct-contact probe · Pellet · PXRD of as-synthesised crystals and pressed/electrically characterised samples; ambient conditions.

Diffraction StructureUnspecified subtype

X-ray diffraction

2016 · Metal-organic framework nanomaterials as novel signal probes for electron transfer mediated ultrasensitive electrochemical immunoassay

as-prepared COF nanoparticles · Powder · XRD pattern of as-prepared COFs.

Diffraction StructureUnspecified subtype

X-ray diffraction

2016 · Metal-organic framework nanomaterials as novel signal probes for electron transfer mediated ultrasensitive electrochemical immunoassay

cleaned HKUST-1 MOFs · Powder · XRD pattern of as-prepared HKUST-1 MOFs.

Diffraction StructurePowder

powder X-ray diffraction

2016 · Modulating the electrical conductivity of metal-organic framework films with intercalated guest π-systems

Pristine BMOF film on ZnO · Thin Film · simulated, bulk powder and film PXRD profiles compared

Diffraction StructureUnspecified subtype

XRD

2016 · Novel CoS2 embedded carbon nanocages by direct sulfurizing metal-organic frameworks for dye-sensitized solar cells

CoS2_4 h CE · Electrode · Powder XRD of as-prepared and annealed CoS2_4 h

Diffraction StructureUnspecified subtype

XRD

2016 · Novel CoS2 embedded carbon nanocages by direct sulfurizing metal-organic frameworks for dye-sensitized solar cells

as-prepared ZIF-67 · Powder · Cu Kalpha radiation; 1 deg min-1 scan rate

Diffraction StructurePowder

X-ray powder diffraction pattern matching

2016 · Proton Transport in a Highly Conductive Porous Zirconium-Based Metal-Organic Framework: Molecular Insight

UiO-66(Zr)-(CO2D)2 characterisation powder · Powder · Bruker D8 Advance, Cu Kalpha1 radiation, Debye-Scherrer geometry; Topas indexing and pattern matching.

Diffraction StructureUnspecified subtype

Out-of-plane XRD

2016 · Superexchange Charge Transport in Loaded Metal Organic Frameworks

F4-TCNQ-loaded HKUST-1 SURMOF, 5 spray cycles · Thin Film · Representative 5 spray-cycle F4-TCNQ-loaded SURMOF compared with pristine film.

Diffraction StructureUnspecified subtype

Out-of-plane XRD

2016 · Superexchange Charge Transport in Loaded Metal Organic Frameworks

Pristine HKUST-1 SURMOF, 5 spray cycles · Thin Film · Bruker D8 Advance theta-theta geometry, Cu K alpha radiation, 5-25 degree 2theta, 0.024 degree step, 16.4 s per step.

Diffraction StructureUnspecified subtype

Out-of-plane XRD

2016 · Superexchange Charge Transport in Loaded Metal Organic Frameworks

TCNQ-loaded HKUST-1 SURMOF, 5 spray cycles · Thin Film · Representative 5 spray-cycle TCNQ-loaded SURMOF compared with pristine film.

Diffraction StructurePowder

Powder/thin-film XRD

2015 · A porous proton-relaying metal-organic framework material that accelerates electrochemical hydrogen evolution

NU-1000_Ni-S · Electrode · PXRD patterns of simulated NU-1000, FTO_NU-1000 and NU-1000_Ni-S.

Diffraction StructurePowderGrazing incidenceRefinement

Synchrotron GIXRD and laboratory PXRD with Pawley refinement

2015 · A two-dimensional π-d conjugated coordination polymer with extremely high electrical conductivity and ambipolar transport behaviour

60 nm Cu-BHT film · Thin Film · Out-of-plane and in-plane GIXRD at Beijing Synchrotron Radiation Facility, lambda=1.5398 A, 2theta 5-40 deg, 0.05 deg increment, room temperature; PXRD with Cu Kalpha lambda=1.5406 A on ground films.

PorosityGrazing incidence

Structural-model inspection from GIXRD/DFT-derived topology

2015 · A two-dimensional π-d conjugated coordination polymer with extremely high electrical conductivity and ambipolar transport behaviour

60 nm Cu-BHT film · Thin Film · No gas sorption porosity measurement reported; porosity inferred qualitatively from proposed dense 2D lattice.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2015 · Benign preparation of metal–organic frameworks of trimesic acid and Cu, Co or Ni for potential sensor applications

TMA-Co(II) powder · Powder · Ultima IV Rigaku diffractometer on powdered TMA-M samples; peak analysis reported in Table I.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2015 · Benign preparation of metal–organic frameworks of trimesic acid and Cu, Co or Ni for potential sensor applications

TMA-Cu(II) powder · Powder · Ultima IV Rigaku diffractometer on powdered TMA-M samples; peak analysis reported in Table I.

Diffraction StructurePowder

Powder X-ray diffraction (XRD)

2015 · Benign preparation of metal–organic frameworks of trimesic acid and Cu, Co or Ni for potential sensor applications

TMA-Ni(II) powder · Powder · Ultima IV Rigaku diffractometer on powdered TMA-M samples; peak analysis reported in Table I.

Diffraction StructurePowder

powder X-ray diffraction

2015 · Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks

Cd2(TTFTB) dark red needle single crystals · Single Crystal · PXRD recorded on Bruker D8 Discover using Ni-filtered Cu-Kalpha radiation; samples on zero-background silicon plate.

Diffraction StructurePowder

powder X-ray diffraction

2015 · Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks

Co2(TTFTB) dark red single crystals · Single Crystal · PXRD recorded on Bruker D8 Discover using Ni-filtered Cu-Kalpha radiation; samples on zero-background silicon plate.

Diffraction StructurePowder

powder X-ray diffraction

2015 · Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks

Mn2(TTFTB) dark red single crystals · Single Crystal · PXRD recorded on Bruker D8 Discover using Ni-filtered Cu-Kalpha radiation; samples on zero-background silicon plate.

Diffraction StructurePowder

powder X-ray diffraction

2015 · Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks

Zn2(TTFTB) single crystals · Single Crystal · PXRD recorded on Bruker D8 Discover using Ni-filtered Cu-Kalpha radiation; samples on zero-background silicon plate.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction with Mo Kalpha radiation

2015 · Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks

Cd2(TTFTB) dark red needle single crystals · Single Crystal · Low-temperature data collected on a Siemens three-circle diffractometer/Bruker APEX CCD; structure solved with SHELXS and refined with SHELXL-97.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction with Mo Kalpha radiation

2015 · Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks

Co2(TTFTB) dark red single crystals · Single Crystal · Low-temperature data collected on a Siemens three-circle diffractometer/Bruker APEX CCD; structure solved with SHELXS and refined with SHELXL-97.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction with Mo Kalpha radiation

2015 · Cation-dependent intrinsic electrical conductivity in isostructural tetrathiafulvalene-based microporous metal-organic frameworks

Mn2(TTFTB) dark red single crystals · Single Crystal · Low-temperature data collected on a Siemens three-circle diffractometer/Bruker APEX CCD; structure solved with SHELXS and refined with SHELXL-97.

Diffraction StructureUnspecified subtype

X-ray diffraction

2015 · Charge Transfer-Induced Molecular Hole Doping into Thin Film of Metal-Organic Frameworks

Pristine Co3(NDC)3 LbL film on amine-functionalised glass · Thin Film · Bulk powder, doctor-blade film, and LbL film compared.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2015 · Chemiresistive Sensor Arrays from Conductive 2D Metal-Organic Frameworks

Drop-cast MOF 1-3 chemiresistor array · Electrode · Bruker D8 Advance with Cu K alpha source in theta/2theta Bragg-Brentano geometry; thin layer on zero-background silicon.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Mo Kalpha radiation

2015 · Co-Ca Phosphonate Showing Humidity-Sensitive Single Crystal to Single Crystal Structural Transformation and Tunable Proton Conduction Properties

Air-dried CoCa.2H2O crystals · Single Crystal · CoCa.2H2O crystal measured at 296 K.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Mo Kalpha radiation

2015 · Co-Ca Phosphonate Showing Humidity-Sensitive Single Crystal to Single Crystal Structural Transformation and Tunable Proton Conduction Properties

Fresh violet sheet-like CoCa.4H2O crystals · Single Crystal · CoCa.4H2O crystal sealed in mother solution; data collected at 296 K and a second crystal at 123 K for H-bond network confirmation.

Diffraction StructurePowder

Powder X-ray diffraction

2015 · Confinement of single polysilane chains in coordination nanospaces

1a-PMPrS powder composite, 30 wt percent PMPrS · Powder · XRPD collected with Cu Kalpha radiation on a Rigaku RINT 2000 Ultima diffractometer.

Diffraction StructurePowder

Powder X-ray diffraction

2015 · Confinement of single polysilane chains in coordination nanospaces

1b-PMPrS powder composite, 30 wt percent PMPrS · Powder · XRPD collected with Cu Kalpha radiation on a Rigaku RINT 2000 Ultima diffractometer.

Diffraction StructurePowder

PXRD and XPS of Cu3(HITP)2 from Cu(I) route

2015 · Cu3(hexaiminotriphenylene)2: An electrically conductive 2D metal-organic framework for chemiresistive sensing

Cu3(HITP)2 synthesised from Cu(I) precursor · Powder · Alternate Cu(I)-precursor sample compared by PXRD and Cu 2p XPS to typical Cu(II)-route material and Cu metal control.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2015 · Cu3(hexaiminotriphenylene)2: An electrically conductive 2D metal-organic framework for chemiresistive sensing

Bulk Cu3(HITP)2 black crystalline solid · Powder · PXRD with Cu Kalpha source in theta/2theta Bragg-Brentano geometry; simulated and experimental patterns compared.

Diffraction StructurePowder

PXRD and Cu 2p XPS of Cu(opd)2/Cu metal control

2015 · Cu3(hexaiminotriphenylene)2: An electrically conductive 2D metal-organic framework for chemiresistive sensing

Crude Cu(opd)2 anaerobic control product · Powder · Anaerobic Cu(OAc)2/opd control reaction product characterised to identify Cu metal signatures.

Diffraction StructureUnspecified subtype

XRD using Bruker-AXS diffractometer

2015 · Effect of solvent on the perovskite thin film morphology and crystallinity

DMF-derived MAPbI3 film on mesoporous TiO2 · Thin Film · DMF-derived film after 100 C heating for 0.5 h in glovebox.

Diffraction StructureUnspecified subtype

XRD using Bruker-AXS diffractometer

2015 · Effect of solvent on the perovskite thin film morphology and crystallinity

unannealed DMF-derived PbI2-MAI-DMF layered MOF film · Thin Film · Unheated DMF-derived spin-coated film; samples prepared in glovebox, sealed in quartz box, measured within 10 min, RH below 40%.

Diffraction StructureUnspecified subtype

XRD using Bruker-AXS diffractometer

2015 · Effect of solvent on the perovskite thin film morphology and crystallinity

GBL-derived MAPbI3 film on mesoporous TiO2 · Thin Film · GBL-derived spin-coated film after annealing.

Diffraction StructurePowder

High-resolution powder X-ray diffraction

2015 · Electronic Conductivity, Ferrimagnetic Ordering, and Reductive Insertion Mediated by Organic Mixed-Valence in a Ferric Semiquinoid Metal-Organic Framework

Brown microcrystalline powder of 2 · Powder · Microcrystalline samples loaded in 1.0 mm boron-rich glass capillaries in Ar glovebox and flame-sealed; lambda = 0.72768 A.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2015 · Electronic Conductivity, Ferrimagnetic Ordering, and Reductive Insertion Mediated by Organic Mixed-Valence in a Ferric Semiquinoid Metal-Organic Framework

Black cubic crystals of 1 · Single Crystal · Synchrotron radiation lambda = 0.8856 A; Bruker PHOTON100 CMOS; structure solved with SHELXS and refined with SHELXL/OLEX2.

Diffraction StructureUnspecified subtype

SEM and X-ray diffraction of MOF-sensitised TiO2 photoanode

2015 · Facile interfacial charge transfer across hole doped cobalt-based MOFs/TiO2 nano-hybrids making MOFs light harvesting active layers in solar cells

Pristine Co-BDC/TiO2/FTO photoanode · Electrode · TiO2/FTO before and after 20 LBL cycles of Co-BDC.

Diffraction StructureUnspecified subtype

SEM and X-ray diffraction of MOF-sensitised TiO2 photoanode

2015 · Facile interfacial charge transfer across hole doped cobalt-based MOFs/TiO2 nano-hybrids making MOFs light harvesting active layers in solar cells

Pristine Co-NDC/TiO2/FTO photoanode · Electrode · TiO2/FTO before and after 20 LBL cycles of Co-NDC.

Diffraction StructureUnspecified subtype

X-ray diffraction

2015 · Facile interfacial charge transfer across hole doped cobalt-based MOFs/TiO2 nano-hybrids making MOFs light harvesting active layers in solar cells

Pristine Co-BDC LBL film on amine-functionalised glass · Thin Film · LBL film compared with bulk Co-BDC powder reference.

Diffraction StructureUnspecified subtype

X-ray diffraction

2015 · Facile interfacial charge transfer across hole doped cobalt-based MOFs/TiO2 nano-hybrids making MOFs light harvesting active layers in solar cells

Pristine Co-NDC LBL film on amine-functionalised glass · Thin Film · LBL film compared with bulk Co-NDC powder reference.

Diffraction StructurePowder

Powder X-ray diffraction in reflection mode; Inel Equinox 1000; monochromated Cu-Kalpha radiation, lambda = 1.5406 A

2015 · Highly Polarizable Triiodide Anions (I3-) as Cross-Linkers for Coordination Polymers: Closing the Semiconductive Band Gap

powder sample of compound 1 · Powder · Room temperature; X-ray tube operated at 30 kV and 30 mA. Patterns compared for calculated single-crystal structure, as-made bulk powder, and sample after boiling water treatment for 24 h.

Diffraction StructurePowder

PXRD and variable-temperature PXRD

2015 · Million-fold electrical conductivity enhancement in Fe2(DEBDC) versus Mn2(DEBDC) (E = S, O)

Fe2(DSBDC)(DMF)2 · Pellet · Room-temperature and variable-temperature PXRD under dynamic vacuum from 25 to 200 degC.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2015 · Million-fold electrical conductivity enhancement in Fe2(DEBDC) versus Mn2(DEBDC) (E = S, O)

Fe2(DSBDC)(DMF)2.x(DMF) · Pellet · Low-temperature 100 K diffraction with Mo Kalpha radiation; SHELXS/SHELXL refinement.

Diffraction StructureUnspecified subtype

Out-of-plane and in-plane X-ray diffraction

2015 · Photoinduced Charge-Carrier Generation in Epitaxial MOF Thin Films: High Efficiency as a Result of an Indirect Electronic Band Gap?

Free-base porphyrin Zn-SURMOF 2/FTO, 300 nm · Electrode · Cu Kalpha radiation; 2theta 2-20 deg; out-of-plane and in-plane geometries for oriented film on FTO.

Diffraction StructureUnspecified subtype

Out-of-plane X-ray diffraction

2015 · Photoinduced Charge-Carrier Generation in Epitaxial MOF Thin Films: High Efficiency as a Result of an Indirect Electronic Band Gap?

Pd porphyrin Zn-SURMOF 2 thin films on various substrates · Thin Film · Pd porphyrin Zn-SURMOF 2 fabricated on quartz glass, MHDA/Au, FTO glass and glass.

Diffraction StructureGrazing incidence

Grazing-incidence X-ray diffraction and scanning electron microscopy

2015 · Thin film thermoelectric metal-organic framework with high seebeck coefficient and low thermal conductivity

Pristine Cu3(BTC)2 thin-film device on quartz · Thin Film · Cu3(BTC)2 thin films before/after TCNQ infiltration; supporting XRD plotted for HKUST-1 before and after infiltration.

Diffraction StructureTotal scattering / PDF

X-ray total scattering and PDF

2015 · Topochemical conversion of a dense metal-organic framework from a crystalline insulator to an amorphous semiconductor

Compound 3 vacuum-dried black monolith · Unknown · Ag Kalpha total scattering for compounds 1, 2 and 3; synchrotron PDF for 3 at Diamond I15.

Diffraction StructurePowderSingle crystalRefinement

Single-crystal X-ray diffraction and powder X-ray diffraction/Pawley fitting

2015 · Topochemical conversion of a dense metal-organic framework from a crystalline insulator to an amorphous semiconductor

Compound 1 reddish-orange octahedral crystals · Single Crystal · Single-crystal diffraction at 120 K, 303 K and 400 K using Cu Kalpha radiation; PXRD phase-purity check with Bruker-AXS D8 and GSAS-II Pawley fitting.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2015 · Tunneling Electrical Connection to the Interior of Metal-Organic Frameworks

AgNC@Rb-CD-MOF from 10 mM AgNO3 · Single Crystal · Blank and AgNC@Rb-CD-MOF after infiltration and after white-light irradiation at 595 mW/cm2 for 24 h

PorosityPowder

N2 sorption/BET at 77 K and PXRD

2015 · Tunneling Electrical Connection to the Interior of Metal-Organic Frameworks

Blank MIL-53(Al), Basolite A100 · Powder · Blank MIL-53 and AgNCs@MIL-53 crystals prepared using 0.5 M AgNO3

Diffraction StructurePowder

Powder X-ray diffraction

2014 · A europium(III) based metal-organic framework: Bifunctional properties related to sensing and electronic conductivity

I2-incorporated EuL crystals · Single Crystal · Representative outgassed, I2-incorporated, Cu2+-incorporated, acetone-incorporated and DMF-incorporated EuL samples compared with simulated pattern.

Diffraction StructurePowder

Powder X-ray diffraction with Cu Kalpha radiation

2014 · Characterization of a copper phosphate triazole metal organic framework material (Cu3PO4(C2N3H 2)2OH) and oxygen evolution studies

As-synthesised Cu3PO4(C2N3H2)2OH blue needle-like crystals · Single Crystal · Scan rate 2 degrees 2theta min-1 over 2theta range 5-40 degrees.

Diffraction StructureSingle crystal

hydrogen-bond distance analysis from SCXRD-derived structures

2014 · Control of crystalline proton-conducting pathways by water-induced transformations of hydrogen-bonding networks in a metal-organic framework

as-synthesised 1·3H2O crystals · Single Crystal · hydrogen-bond distances tabulated for 1·3H2O, 1·2H2O and 1 in SI Tables S4-S6

Diffraction StructureSingle crystal

single-crystal X-ray diffraction on Rigaku AFC-7R using graphite-monochromatic Mo Kα radiation

2014 · Control of crystalline proton-conducting pathways by water-induced transformations of hydrogen-bonding networks in a metal-organic framework

as-synthesised 1·3H2O crystals · Single Crystal · as-synthesised crystal immediately cooled to 113 K under N2 flow after mounting from mother liquid; structure solved by SIR2004 and refined on F2 with SHELXL-97

Diffraction StructurePowder

XRPD using Bruker D8 ADVANCE, Cu Kα radiation

2014 · Control of crystalline proton-conducting pathways by water-induced transformations of hydrogen-bonding networks in a metal-organic framework

air-dried 1·2H2O sample · Powder · powdered samples made from ground single crystals compared with pattern simulated from SCXRD structure

Diffraction StructurePowderRefinement

Synchrotron XRPD Rietveld refinement

2014 · Design and synthesis of hydroxide ion-conductive metal-organic frameworks based on salt inclusion

NBu4-ZIF-8 powder · Powder · BL44B2 at SPring-8; wavelength 0.499081(1) angstrom; vacuum-packed borosilicate capillary irradiated for 14 min at 300 K.

Diffraction StructurePowderRefinement

Synchrotron XRPD Rietveld refinement

2014 · Design and synthesis of hydroxide ion-conductive metal-organic frameworks based on salt inclusion

ZIF-8 powder · Powder · BL44B2 at SPring-8; wavelength 0.799139(1) angstrom; vacuum-packed borosilicate capillary irradiated for 2.5 min at 300 K.

Diffraction StructurePowder

Powder X-ray diffraction, Rigaku Dmax, Cu-Kalpha radiation

2014 · Immobilization of N-(3-aminopropyl)-imidazole through MOFs in proton conductive membrane for elevated temperature anhydrous applications

activated Fe-MIL-101-NH2 / pure MOFs · Powder · PXRD comparison of simulated Fe-MIL-101, pristine MOFs, MOFs>NAPI, CHCl3-washed MOFs>NAPI and membrane

Diffraction StructurePowder

Powder X-ray diffraction

2014 · Pd uptake and H2S sensing by an amphoteric metal-organic framework with a soft core and rigid side arms

BFMOF-1a desolvated/solvent-exchanged crystals · Single Crystal · Reflection mode at room temperature on Inel Equinox 1000 X-ray diffractometer with Cu-Kalpha1 radiation, 30 kV and 30 mA.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2014 · Pd uptake and H2S sensing by an amphoteric metal-organic framework with a soft core and rigid side arms

As-prepared BFMOF-1 single crystals · Single Crystal · Bruker APEX II CCD, 100 K, Mo Kalpha radiation; refined in P-1.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2014 · Pd uptake and H2S sensing by an amphoteric metal-organic framework with a soft core and rigid side arms

BFMOF-1-DMF single crystal · Single Crystal · Bruker AXS SMART APEX CCD, 100 K, Mo Kalpha radiation; refined in P-1.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2014 · Pd uptake and H2S sensing by an amphoteric metal-organic framework with a soft core and rigid side arms

BFMOF-1a desolvated/solvent-exchanged crystals · Single Crystal · Bruker APEX II CCD, 100 K, Mo Kalpha radiation; refined in P-1.

Diffraction StructurePowder

powder X-ray diffraction

2014 · Reversible iodine absorption of nonporous coordination polymer Cu(TCNQ)

Cu(TCNQ)I4 from phase I by liquid-phase iodine absorption · Powder · phase I Cu(TCNQ) before liquid-phase iodine absorption, after absorption, and after annealing desorption

Diffraction StructurePowder

powder X-ray diffraction

2014 · Reversible iodine absorption of nonporous coordination polymer Cu(TCNQ)

regenerated phase II Cu(TCNQ) after iodine desorption by annealing · Powder · repeated absorption-desorption experiments on phase I and phase II Cu(TCNQ)

Diffraction StructurePowder

powder X-ray diffraction

2014 · Reversible iodine absorption of nonporous coordination polymer Cu(TCNQ)

Cu(TCNQ)I2 from phase I by stepwise solid-state iodine addition · Powder · Cu(TCNQ)In n = 1, 2, and 4 from stepwise solid-state reaction of phase I

Diffraction StructurePowder

powder X-ray diffraction

2014 · Reversible iodine absorption of nonporous coordination polymer Cu(TCNQ)

Cu(TCNQ)I2 from phase II by stepwise solid-state iodine addition · Powder · Cu(TCNQ)In n = 1, 2, 3, and 4 from stepwise solid-state reaction of phase II

Diffraction StructurePowder

Powder X-ray diffraction time-course for solvent-free SCSC transformation

2014 · Solid-state structural transformation doubly triggered by reaction temperature and time in 3D metal-organic frameworks: Great enhancement of stability and gas adsorption

IFMC-68/IFMC-69 intermediate transformation mixture · Single Crystal · IFMC-68 heated in a sealed Teflon reactor at 140 C for 6, 12, 18, 21, 24, 48, and 72 h.

Diffraction StructurePowder

PXRD air-stability comparison

2014 · Solid-state structural transformation doubly triggered by reaction temperature and time in 3D metal-organic frameworks: Great enhancement of stability and gas adsorption

as-synthesised IFMC-69 colourless crystals · Single Crystal · IFMC-68 exposed to air for 0, 2, and 6 h; IFMC-69 exposed to air up to two months.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2014 · Solid-state structural transformation doubly triggered by reaction temperature and time in 3D metal-organic frameworks: Great enhancement of stability and gas adsorption

as-synthesised IFMC-68 colourless crystals · Single Crystal · Bruker Apex CCD, Mo-Kalpha radiation; structure solved/refined with SHELXS/SHELXL and PLATON SQUEEZE.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2014 · Solid-state structural transformation doubly triggered by reaction temperature and time in 3D metal-organic frameworks: Great enhancement of stability and gas adsorption

as-synthesised IFMC-69 colourless crystals · Single Crystal · Bruker Apex CCD, Mo-Kalpha radiation; structure solved/refined with SHELXS/SHELXL and PLATON SQUEEZE.

Diffraction StructurePowderGrazing incidence

grazing-incidence powder X-ray diffraction (PXRD)

2014 · Solvothermal preparation of an electrocatalytic metalloporphyrin MOF thin film and its redox hopping charge-transfer mechanism

CoPIZA/FTO thin film electrode · Electrode · Rigaku Altima IV; Cu Kalpha radiation, grazing incidence thin-film stage, 2theta range 5-50 deg, 0.05 deg steps, 0.5 deg/min.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Bruker Smart CCD, Mo-Kalpha radiation

2014 · Structural, magnetic and electrical properties of one-dimensional tetraamidatodiruthenium compounds

Compound 1 single crystals and microcrystalline powder · Single Crystal · Room-temperature data collection; structures solved by direct methods and refined on F2 with SHELXL-97; crystal/refinement data in SI and CIF.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Bruker Smart CCD, Mo-Kalpha radiation

2014 · Structural, magnetic and electrical properties of one-dimensional tetraamidatodiruthenium compounds

Compound 2 crystalline solid / powder · Single Crystal · Room-temperature data collection; structures solved by direct methods and refined on F2 with SHELXL-97; crystal/refinement data in SI and CIF.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Bruker Smart CCD, Mo-Kalpha radiation

2014 · Structural, magnetic and electrical properties of one-dimensional tetraamidatodiruthenium compounds

Compound 3 crystalline solid / powder · Single Crystal · Room-temperature data collection; structures solved by direct methods and refined on F2 with SHELXL-97; crystal/refinement data in SI and CIF.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Bruker Smart CCD, Mo-Kalpha radiation

2014 · Structural, magnetic and electrical properties of one-dimensional tetraamidatodiruthenium compounds

Compound 4 single crystals and microcrystalline powder · Single Crystal · Room-temperature data collection; structures solved by direct methods and refined on F2 with SHELXL-97; crystal/refinement data in SI and CIF.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Bruker Smart CCD, Mo-Kalpha radiation

2014 · Structural, magnetic and electrical properties of one-dimensional tetraamidatodiruthenium compounds

Compound 5 crystalline solid / powder · Single Crystal · Room-temperature data collection; structures solved by direct methods and refined on F2 with SHELXL-97; crystal/refinement data in SI and CIF.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction, Bruker Smart CCD, Mo-Kalpha radiation

2014 · Structural, magnetic and electrical properties of one-dimensional tetraamidatodiruthenium compounds

Compound 6 crystalline solid / powder · Single Crystal · Room-temperature data collection; structures solved by direct methods and refined on F2 with SHELXL-97; crystal/refinement data in SI and CIF.

Diffraction StructurePowder

Powder X-ray diffraction

2014 · Synthesis, characterisation and thermal degradation behaviour of some coordination polymers by using TG-DTG and DTA techniques

Cu(II)-fbpmpc coordination polymer powder · Powder · Solid-state powder XRD for all four coordination polymers; Cu sample used as the measurement anchor because it was the only polymer with weak crystallinity.

Diffraction StructurePowder

powder X-ray diffraction (PXRD/XRPD), Cu Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 1 colourless crystals · Single Crystal · experimental patterns compared with simulated patterns from single-crystal models

Diffraction StructurePowder

powder X-ray diffraction (PXRD/XRPD), Cu Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 2 colourless crystals · Single Crystal · experimental patterns compared with simulated patterns from single-crystal models

Diffraction StructurePowder

powder X-ray diffraction (PXRD/XRPD), Cu Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 3 colourless crystals · Single Crystal · experimental patterns compared with simulated patterns from single-crystal models

Diffraction StructurePowder

powder X-ray diffraction (PXRD/XRPD), Cu Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 4 colourless crystals · Single Crystal · experimental patterns compared with simulated patterns from single-crystal models

Diffraction StructurePowder

powder X-ray diffraction (PXRD/XRPD), Cu Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 5 colourless crystals · Single Crystal · experimental patterns compared with simulated patterns from single-crystal models

Diffraction StructurePowder

powder X-ray diffraction (PXRD/XRPD), Cu Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 6 colourless crystals · Single Crystal · experimental patterns compared with simulated patterns from single-crystal models

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker APEX II CCD, Mo Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 1 colourless crystals · Single Crystal · structures solved by direct methods and refined by SHELXTL; main Table 1 and CIF data

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker APEX II CCD, Mo Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 2 colourless crystals · Single Crystal · structures solved by direct methods and refined by SHELXTL; main Table 1 and CIF data

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker APEX II CCD, Mo Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 3 colourless crystals · Single Crystal · structures solved by direct methods and refined by SHELXTL; main Table 1 and CIF data

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker APEX II CCD, Mo Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 4 colourless crystals · Single Crystal · structures solved by direct methods and refined by SHELXTL; main Table 1 and CIF data

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker APEX II CCD, Mo Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 5 colourless crystals · Single Crystal · structures solved by direct methods and refined by SHELXTL; main Table 1 and CIF data

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker APEX II CCD, Mo Kalpha

2013 · Alkali-metal-regulated construction of superhydrophilic ZnII and CdII coordination polymers with perhalogenated terephthalate ligands

Complex 6 colourless crystals · Single Crystal · structures solved by direct methods and refined by SHELXTL; main Table 1 and CIF data

Diffraction StructurePowder

Powder X-ray diffraction, Bruker D8 Advance

2013 · Bi-porous metal-organic framework with hydrophilic and hydrophobic channels: Selective gas sorption and reversible iodine uptake studies

guest-free activated compound 1' · Pellet · PXRD patterns measured from 5 to 40 deg 2theta at 0.5 seconds per step; samples exposed to air during collection.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction using Rigaku Mercury70 diffractometer with graphite-monochromated Mo-Kalpha radiation

2013 · Crystal structure and carrier transport properties of a new semiconducting 2D coordination polymer with a 3,5-dimethylpiperidine dithiocarbamate ligand

Complex 1 black single crystals · Single Crystal · Data collected at -153 deg C / about 120 K up to maximum 2theta = 55.0 deg; numerical absorption correction applied.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction with Mo Kalpha radiation; structure solved with WINGX/SHELXS-97 and refined with SHELXL-97

2013 · Electrical bistability around room temperature in an unprecedented one-dimensional coordination magnetic polymer

Crystalline compound 1 product · Single Crystal · Crystal grown from THF/H2O/n-hexane, coated in FomblinY, mounted on glass fibre, data collected at 200 K under low-temperature nitrogen stream on Bruker-Nonius Kappa CCD with Oxford Cryostream 700.

Diffraction StructurePowder

Powder X-ray diffraction

2013 · Mn2(2,5-disulfhydrylbenzene-1,4-dicarboxylate): A microporous metal-organic framework with infinite (-Mn-S-)∞ chains and high intrinsic charge mobility

Activated 1 powder · Powder · Activated 1 prepared on glass slide inside airtight specimen holder with X-ray transparent cap.

Diffraction StructurePowder

Powder X-ray diffraction

2013 · Mn2(2,5-disulfhydrylbenzene-1,4-dicarboxylate): A microporous metal-organic framework with infinite (-Mn-S-)∞ chains and high intrinsic charge mobility

As-synthesized 1 powder · Powder · Bruker D8 Advance, theta/2theta geometry, nickel-filtered Cu K alpha radiation.

Diffraction StructurePowder

Powder X-ray diffraction

2013 · Mn2(2,5-disulfhydrylbenzene-1,4-dicarboxylate): A microporous metal-organic framework with infinite (-Mn-S-)∞ chains and high intrinsic charge mobility

Methanol-exchanged 1 powder · Powder · Bruker D8 Advance, theta/2theta geometry, nickel-filtered Cu K alpha radiation.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2013 · Mn2(2,5-disulfhydrylbenzene-1,4-dicarboxylate): A microporous metal-organic framework with infinite (-Mn-S-)∞ chains and high intrinsic charge mobility

As-synthesized 1 single crystal · Single Crystal · 100 K data collected with Mo K alpha radiation, lambda 0.71073 Angstrom; SHELXS/SHELXL refinement.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2013 · Two one-dimensional germanium(IV) coordination polymers based on macrocyclic tetraaza[14]annulene with notable semiconducting property

compound 1 orange single crystals · Single Crystal · Bruker SMART APEX II CCD area detector, Mo Kalpha radiation, 296(2) K; structure solved with SHELXL/SHELXTL.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2013 · Two one-dimensional germanium(IV) coordination polymers based on macrocyclic tetraaza[14]annulene with notable semiconducting property

compound 2 orange single crystals · Single Crystal · Bruker SMART APEX II CCD area detector, Mo Kalpha radiation, 296(2) K; structure solved with SHELXL/SHELXTL.

Diffraction StructurePowder

powder X-ray diffraction (Rigaku RINT2500)

2012 · Electrochemical reduction of carbon dioxide using a copper rubeanate metal organic framework

air-dried CR-MOF particles · Powder · Powder XRD used to assess crystallinity and compare peak positions with literature.

Diffraction StructurePowder

Powder X-ray diffraction

2012 · High charge mobility in a tetrathiafulvalene-based microporous metal-organic framework

Desolvated/activated compound 1 powder · Powder · Bruker D8 Advance, theta/2theta Bragg-Brentano, nickel-filtered Cu Kalpha radiation; as-synthesised, simulated and desolvated patterns compared.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction and full-matrix least-squares refinement

2012 · High charge mobility in a tetrathiafulvalene-based microporous metal-organic framework

X-ray quality dark red needles of compound 1 · Single Crystal · Low-temperature 100 K data collected on Bruker-AXS X8 Kappa Duo with Mo Kalpha radiation lambda = 0.71073 A; SADABS corrections; SHELXS/SHELXL-97 refinement.

Diffraction StructurePowder

PXRD / powder diffractogram

2012 · High performance metal–organic-framework coatings obtained via thermal gradient synthesis

HKUST-1 coating on 5 cm x 5 cm copper sheet · Thin Film · Powder diffraction patterns measured using Bruker D8 Advance with Cu-Kalpha radiation and LYNXEYE detector, Bragg-Brentano geometry, 4 s/0.01 deg per step.

Diffraction StructurePowder

Water-vapour cycling followed by PXRD

2012 · High performance metal–organic-framework coatings obtained via thermal gradient synthesis

HKUST-1 coating after 500 water-vapour ad/desorption cycles · Thin Film · Vacuum chamber with water vapour of 12 mbar; temperatures alternated between 15 and 120 deg C for 90 s each over 500 cycles; PXRD before/after cycling.

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; direct-method solution and SHELX refinement

2012 · Novel semiconducting metal-organic framework: Synthesis, structural characterisation and electrical conductivity studies of manganese based two dimensional coordination polymer

Pale yellow [Mn(mu-pz)(mu-Cl)2]n crystals · Single Crystal · CCD Oxford Diffraction XCALIBUR-S diffractometer, Oxford Instruments low-temperature attachment, graphite-monochromated Mo Kalpha radiation.

Diffraction StructurePowderRefinement

powder X-ray diffraction with Rietveld refinement using Fullprof

2012 · Stable organic radical stacked by in situ coordination to rare earth cations in MOF materials

Pr-, Nd-, Sm-, Eu-, Gd-, Tb-, Dy-, Ho- and Er-RPF8 bulk powders · Powder · Bruker D8 diffractometer with PSD detector; 2theta 5-60 degrees; step size 0.02 degrees; exposure time 2 s per step.

Diffraction StructureSingle crystalRefinement

single-crystal X-ray diffraction on SMART-CCD Bruker diffractometer; Mo Kalpha radiation; SHELXTL refinement

2012 · Stable organic radical stacked by in situ coordination to rare earth cations in MOF materials

La-, Pr-, Sm- and Gd-RPF8 single crystals for X-ray diffraction · Single Crystal · Room-temperature data collection, Mo Kalpha lambda = 0.71073 Angstrom, hemisphere of reciprocal space, 20 s exposures covering 0.3 degrees in omega.

Diffraction StructurePowder

Powder X-ray diffraction (PXRD)

2012 · Synthesis, characterization and solid state electrical properties of 1-D coordination polymer of the type [CuxNi1-x(dadb) ·yH2O]n

Complex 4 powder / pressed pellet · Powder · PXRD with Cu Kalpha radiation at room temperature; comparison among complexes 2, 3, 4, 7 and mixtures.

Diffraction StructurePowder

Powder X-ray diffraction

2012 · Synthesis, characterization, and solid state electrical conductivity of coordination polymers with copper and zinc

Complex 2 compressed pellet · Pellet · Room-temperature PXRD with Cu-Kalpha radiation, lambda = 1.541836 A.

Diffraction StructurePowder

Powder X-ray diffraction

2012 · Synthesis, characterization, and solid state electrical conductivity of coordination polymers with copper and zinc

Complex 3 compressed pellet · Pellet · Room-temperature PXRD with Cu-Kalpha radiation.

Diffraction StructurePowder

Powder X-ray diffraction

2012 · Synthesis, characterization, and solid state electrical conductivity of coordination polymers with copper and zinc

Complex 4 compressed pellet · Pellet · Room-temperature PXRD compared with complexes 2, 3 and their equimolar mixture.

Diffraction StructurePowder

Powder X-ray diffraction

2012 · Synthesis, characterization, and solid state electrical conductivity of coordination polymers with copper and zinc

Complex 5 compressed pellet · Pellet · PXRD for complexes 2-6 and equimolar mixture of 2 and 3.

Diffraction StructurePowder

Powder X-ray diffraction

2012 · Synthesis, characterization, and solid state electrical conductivity of coordination polymers with copper and zinc

Complex 6 compressed pellet · Pellet · PXRD for complexes 2-6 and equimolar mixture of 2 and 3.

Diffraction StructurePowder

Powder X-ray diffraction

2012 · Synthesis, characterization, and solid state electrical conductivity of coordination polymers with copper and zinc

Complex 7 compressed pellet · Pellet · PXRD pattern for 7 compared with 2, 3, 4 and dadb.

Diffraction StructurePowder

powder X-ray diffraction, Rigaku D/M-2200T, Cu Kalpha radiation

2011 · CH⋯Cl relevant discrepancy on structure, magnetic and electronic conductivity of two mixed-valence CuICuII coordination polymers

As-isolated bulk crystals of compound 1 · Powder · 2theta range 5-50 deg, scan speed 4 deg/min, step size 0.02 deg; experimental pattern compared with calculated diffractogram.

Diffraction StructurePowder

powder X-ray diffraction, Rigaku D/M-2200T, Cu Kalpha radiation

2011 · CH⋯Cl relevant discrepancy on structure, magnetic and electronic conductivity of two mixed-valence CuICuII coordination polymers

As-isolated bulk crystals of compound 2 · Powder · 2theta range 5-50 deg, scan speed 4 deg/min, step size 0.02 deg; experimental pattern compared with calculated diffractogram.

Diffraction StructurePowder

Powder X-ray diffraction

2010 · Conductivity, doping, and redox chemistry of a microporous dithiolene-based metal-organic framework

Desolvated Cu[Ni(pdt)2] powder · Powder · PXRD patterns compared for Cu[Cu(pdt)2] and Cu[Ni(pdt)2] as prepared, after 120 degC vacuum treatments, and after iodine doping.

Diffraction StructurePowder

Powder XRD of drop-cast CuAT film

2010 · Highly conducting two-dimensional copper(i) 4-hydroxythiophenolate network

drop-cast CuAT thin film on bottom-contact FET · Thin Film · Drop-cast CuAT film compared with CuHT; SI Fig. S3 gives CuAT film XRD on glass substrate.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2009 · 1-Hydroxybenzotriazole (HOBt) acidity, formation constant with different metals and thermodynamic parameters: Synthesis and characterization of some HOBt metal complexes - Crystal structures of two polymers: [Cu2(H2O)5(OBt)2(μ-OBt)2] · 2H2O · EtOH (1A) and [Cu(μ-OBt)(HOBt)(OBt)(EtOH)] (1B)

1A black-brown single crystals · Single Crystal · Mo Kalpha radiation, lambda = 0.71073 Angstrom; Siemens SMART 1000 CCD; 173(2) K; solved/refined with SHELX-97

Diffraction StructureSingle crystal

single-crystal X-ray diffraction

2009 · 1-Hydroxybenzotriazole (HOBt) acidity, formation constant with different metals and thermodynamic parameters: Synthesis and characterization of some HOBt metal complexes - Crystal structures of two polymers: [Cu2(H2O)5(OBt)2(μ-OBt)2] · 2H2O · EtOH (1A) and [Cu(μ-OBt)(HOBt)(OBt)(EtOH)] (1B)

1B light olive green needles · Single Crystal · Mo Kalpha radiation, lambda = 0.71073 Angstrom; Siemens SMART 1000 CCD; 173(2) K; solved/refined with SHELX-97

Diffraction StructurePowder

Powder X-ray diffraction

2009 · A novel lamella 2D Ag(I) coordination polymer of graphite-like structure featuring short interlayer distance

Bulk powder/crystalline solid of 1 · Powder · Philips X'Pert Pro MPD diffractometer with Cu Kalpha radiation and X'Celerator detector.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2009 · A novel lamella 2D Ag(I) coordination polymer of graphite-like structure featuring short interlayer distance

Pale yellow block crystals of 1 · Single Crystal · Bruker SMART 2000 CCD, omega scan, Mo Kalpha radiation lambda = 0.71073 Angstrom; article reference note reports 173(2) K; CIF metadata reports 298(2) K.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker APEX2 CCD area detector, Mo Kalpha radiation

2009 · Monovalent K, Cs, Tl, and Ag nitrosodicyanomethanides: Completely different 3D networks with useful properties of luminescent materials and nonelectric sensors for gases†

Ag{ONC(CN)2} bright deep-yellow microcrystalline powder · Powder · Single crystal grown from hot saturated water solution upon slow cooling; room-temperature structure solution/refinement.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction, Bruker SMART/CCD area detector, Mo Kalpha radiation

2009 · Monovalent K, Cs, Tl, and Ag nitrosodicyanomethanides: Completely different 3D networks with useful properties of luminescent materials and nonelectric sensors for gases†

Cs{ONC(CN)2} yellow-orange crystals / fine powder · Powder · Single crystals obtained from aqueous solution upon slow evaporation at 4 deg C; room-temperature structure solution/refinement.

Diffraction StructureSingle crystal

single-crystal X-ray diffraction; main experimental section describes Bruker APEX2, CIF lists Stoe IPDS for Tl

2009 · Monovalent K, Cs, Tl, and Ag nitrosodicyanomethanides: Completely different 3D networks with useful properties of luminescent materials and nonelectric sensors for gases†

Tl{ONC(CN)2} dark-orange prisms / fine powder · Powder · Single crystals obtained from aqueous solution upon slow evaporation/crystallisation at 4 deg C; room-temperature structure solution/refinement.

Diffraction StructurePowder

Powder X-ray diffraction

2009 · Semiconducting neutral microstructures fabricated by coordinative self-assembly of intramolecular charge-transfer tetrathiafulvalene derivatives

TTF-Pb coordination-polymer microwires · Powder · XRD of the microstructures used to evaluate intermolecular interactions and pi-pi stacking.

Diffraction StructurePowder

Powder X-ray diffraction

2009 · Semiconducting neutral microstructures fabricated by coordinative self-assembly of intramolecular charge-transfer tetrathiafulvalene derivatives

TTF-Zn spherical coordination-polymer particles · Powder · XRD pattern of Zn-linked spherical particles in SI Figure S15(b), compared with microwires.

Diffraction StructureSingle crystal

Single-crystal X-ray diffraction

2008 · A conducting coordination polymer based on assembled Cu9 cages

compound 2 crystals · Single Crystal · Data collection on single crystals at 100 K; crystallographic parameters in Table SI-3 and selected bond lengths/angles in Table SI-5.

Diffraction StructurePowder

Powder X-ray diffraction of solution-deposited crystallites

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HMTT.BiCl3 (1) solution-deposited crystallites · Thin Film · Room-temperature PXRD, Cu Kalpha, compared with calculated single-crystal patterns

Diffraction StructurePowder

Powder X-ray diffraction

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HMTT.BiBr3 (2) bulk powder/crystallites · Powder · Room-temperature PXRD, Cu Kalpha, 2theta 3-50 deg; compared with calculated pattern

Diffraction StructurePowder

Powder X-ray diffraction of solution-deposited crystallites

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HMTT.BiBr3 (2) solution-deposited crystallites · Thin Film · Room-temperature PXRD, Cu Kalpha, compared with calculated pattern and orientation preference

Diffraction StructurePowder

Powder X-ray diffraction

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HMTT.2BiBr3 (3) bulk powder/crystallites · Powder · Room-temperature PXRD, Cu Kalpha, compared with calculated single-crystal pattern

Diffraction StructurePowder

Powder X-ray diffraction

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HETT.2BiBr3 (4) bulk powder/crystallites · Powder · Room-temperature PXRD, Cu Kalpha, compared with calculated single-crystal pattern

Diffraction StructurePowder

Powder X-ray diffraction of solution-deposited crystallites

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HETT.2BiBr3 (4) solution-deposited crystallites · Thin Film · Room-temperature PXRD, Cu Kalpha, compared with calculated pattern

Diffraction StructurePowder

Powder X-ray diffraction

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HiPTT.2BiBr3.C7H8 (5) bulk powder/crystallites · Powder · Room-temperature PXRD, Cu Kalpha, compared with calculated patterns with and without orientation preference

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; SHELXL-97 refinement

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HMTT.BiBr3 (2) single crystal · Single Crystal · Nonius kappaCCD, Mo Kalpha radiation, 293(2) K

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; SHELXL-97 refinement

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HMTT.2BiBr3 (3) single crystal · Single Crystal · Nonius kappaCCD, Mo Kalpha radiation, 293(2) K

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; SHELXL-97 refinement

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HETT.2BiBr3 (4) single crystal · Single Crystal · Nonius kappaCCD, Mo Kalpha radiation, 293(2) K

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction; SHELXL-97 refinement

2005 · Semiconductive coordination networks from 2,3,6,7,10,11-hexakis(alkylthio) triphenylenes and bismuth(III) halides: Synthesis, structure-property relations, and solution processing

HiPTT.2BiBr3.C7H8 (5) single crystal · Single Crystal · Nonius kappaCCD, Mo Kalpha radiation, 293(2) K

Diffraction StructureSingle crystalRefinement

Single-crystal X-ray diffraction and structure refinement

2000 · Coexistence of ferromagnetism and metallic conductivity in a molecule-based layered compound

Thin shiny brown plate-like single crystals of [BEDT-TTF]3[MnCr(C2O4)3] · Single Crystal · Data obtained at 120 K; final refinement used 1,317 reflections and 151 parameters for I > 4 sigma.

Diffraction StructurePowder

Powder X-ray diffraction

1990 · New coordination polymers of 1,4-bis(2′-hydroxyphenylazomethine) phenylene

Cr-BHPAP polychelate powder · Powder · Philips PW 1710 diffractometer with Ni-filtered Cu radiation.

Diffraction StructurePowder

Powder X-ray diffraction

1990 · New coordination polymers of 1,4-bis(2′-hydroxyphenylazomethine) phenylene

Cu-BHPAP polychelate powder · Powder · Philips PW 1710 diffractometer with Ni-filtered Cu radiation.

Diffraction StructurePowder

Powder X-ray diffraction

1990 · New coordination polymers of 1,4-bis(2′-hydroxyphenylazomethine) phenylene

Fe-BHPAP polychelate powder · Powder · Philips PW 1710 diffractometer with Ni-filtered Cu radiation.

Diffraction StructurePowder

Powder X-ray diffraction

1990 · New coordination polymers of 1,4-bis(2′-hydroxyphenylazomethine) phenylene

Mn-BHPAP polychelate powder · Powder · Philips PW 1710 diffractometer with Ni-filtered Cu radiation.

Diffraction StructurePowder

Powder X-ray diffraction

1990 · New coordination polymers of 1,4-bis(2′-hydroxyphenylazomethine) phenylene

Ni-BHPAP polychelate powder · Powder · Philips PW 1710 diffractometer with Ni-filtered Cu radiation.

Diffraction StructurePowder

Powder X-ray diffraction

1990 · New coordination polymers of 1,4-bis(2′-hydroxyphenylazomethine) phenylene

Ti-BHPAP polychelate powder · Powder · Philips PW 1710 diffractometer with Ni-filtered Cu radiation.

Diffraction StructurePowder

powder X-ray diffraction

1984 · Cofacial Assembly of Metallomacrocycles as an Approach to Controlling Lattice Architecture in Low-Dimensional Molecular Solids. Chemical, Structural, Oxidation-State, Transport, and Optical Properties of the Coordination Polymer [Fe(phthalocyaninato)(μ-pyrazine)]n and the Consequences of Halogen Doping

{[Fe(Pc)(mu-pyz)]I2.54}n, eq 5 · Pellet · Incremental iodination followed by powder X-ray diffraction; repeated benzene washing tested reversibility.

Diffraction StructurePowder

powder X-ray diffraction

1984 · Cofacial Assembly of Metallomacrocycles as an Approach to Controlling Lattice Architecture in Low-Dimensional Molecular Solids. Chemical, Structural, Oxidation-State, Transport, and Optical Properties of the Coordination Polymer [Fe(phthalocyaninato)(μ-pyrazine)]n and the Consequences of Halogen Doping

Table III pristine mu-pyrazine polymer PXRD series · Pellet · Graphite-monochromated, Ni-filtered Co or Cr Kalpha radiation; pressed powders in 13 mm pellets; scan rate 0.25 deg/min.

Raw method vocabulary

These are the exact source-preserving method strings consolidated by this technique group.

Show 1,031 reported method labels
Raw method labelMapped measurements
Powder X-ray diffraction114
powder X-ray diffraction83
Powder X-ray diffraction (PXRD)79
Single-crystal X-ray diffraction56
single-crystal X-ray diffraction51
PXRD40
X-ray diffraction (XRD)27
powder X-ray diffraction (PXRD)26
Powder XRD24
Powder X-ray diffraction (XRD), Cu Kalpha radiation23
Powder X-ray diffraction (XRD)21
X-ray diffraction18
PXRD of mixed-metal alloy; D/S extracted from lattice parameters16
single-crystal X-ray diffraction (SCXRD)15
XRD15
Powder X-ray diffraction with Pawley refinement13
PXRD with Pawley refinement13
PXRD with Rietveld refinement13
PXRD Pawley profile fit12
Powder X-ray diffraction (PXRD), Cu Kalpha radiation11
Powder X-ray diffraction with Cu Kalpha radiation9
powder XRD9
powder X-ray diffraction with Rietveld refinement9
Combined PXRD/FWHM crystallite-size analysis, N2 adsorption BET, UV-vis-NIR Tauc gap and PESA HOMO/LUMO summary9
SC-XRD and PXRD9
PXRD Pawley refinement8
SEM and XRD8
Powder XRD and FT-IR7
PXRD/XRD7
2D GIWAXS7
GIWAXS6
PXRD and TGA6
Single-crystal X-ray diffraction, Bruker Smart CCD, Mo-Kalpha radiation6
powder X-ray diffraction (XRD)6
PXRD [100] reflection FWHM6
PXRD [001] reflection analysis6
Powder X-ray diffraction; Pawley/full-pattern profile matching; charge-flipping/Rietveld where reported6
XRD with Rietveld refinement; ICP-OES/EDS composition; Raman support6
SEM/TEM/EDS elemental mapping and XRD6
powder X-ray diffraction (PXRD/XRPD), Cu Kalpha6
single-crystal X-ray diffraction, Bruker APEX II CCD, Mo Kalpha6
Single-crystal X-ray diffraction; 120 K and room temperature6
PXRD and FT-IR5
GIXRD5
thin-film X-ray diffraction5
Powder X-ray diffraction using Cu Kalpha radiation5
1H NMR and powder X-ray diffraction (PXRD)5
powder X-ray diffraction (PXRD), Cu Kalpha5
X-ray diffraction (PANalytical instrument)5
powder X-ray diffraction (pXRD)5
PXRD compared with simulated pattern5
Laboratory PXRD with Pawley refinement4
Powder X-ray diffraction (Cu K alpha, lambda = 1.5418 A)4
Out-of-plane XRD with Cu Kalpha radiation4
Powder X-ray diffraction (PXRD) with Cu Kalpha radiation; Pawley refinement4
Powder X-ray diffraction (XRD), PANalytical X'Pert3 Powder & Empyrean4
Single-crystal X-ray diffraction; Mo K-alpha; SHELXT/SHELXL refinement4
PXRD, SEM/TEM/HR-TEM, EDS, ATR-IR, XPS and elemental analysis4
TGA under N2/air and PXRD after solvent/acid/base soaking4
Single-crystal X-ray diffraction; Bruker APEX2, Mo Kalpha radiation4
Single-crystal X-ray diffraction, Mo Kalpha radiation4
Powder X-ray diffraction with Cu Ka radiation4
Grazing-incidence X-ray diffraction (GIXRD)4
Out-of-plane XRD4
single-crystal X-ray diffraction and PXRD4
single-crystal X-ray diffraction (SXRD)4
PXRD / synchrotron PXRD4
XRPD4
Powder X-ray diffraction compared with simulated pattern4
X-ray powder diffraction4
Single-crystal X-ray diffraction, Bruker SMART APEX, Mo-Kalpha radiation, SHELXS/SHELXL refinement4
Single-crystal X-ray diffraction; SHELXL-97 refinement4
PXRD/Rietveld refinement4
Single-crystal X-ray diffraction with Mo Kalpha radiation3
PXRD with Pawley refinement and simulated PXRD comparison3
Single-crystal X-ray diffraction (SC-XRD)3
Single-crystal X-ray diffraction with Mo Kalpha radiation; SQUEEZE treatment3
PXRD peak full-width at half-maximum analysis at ca. 4.93 degrees.3
Powder X-ray diffraction with Cu source; refined crystallographic data and PXRD comparison to simulated eclipsed Cu-HHTP.3
High-resolution synchrotron PXRD; Pawley refinement3
Single-crystal X-ray diffraction with SHELXT/SHELXL refinement and SQUEEZE for pore solvent3
Powder X-ray diffraction, Cu Kalpha radiation3
Pawley refinement of PXRD3
Single-crystal X-ray diffraction on Bruker SMART APEX II CCD with Mo Kalpha radiation at 150 K.3
GIWAXS, SEM, TEM and AFM3
powder X-ray diffraction; Pawley refinement3
Powder XRD with Cu-Kalpha radiation3
Out-of-plane and in-plane X-ray diffraction3
Out-of-plane X-ray diffraction3
variable-temperature X-ray powder diffraction3
Powder X-ray diffraction using Bruker D8 Advance, theta/2theta Bragg-Brentano geometry, Cu Kalpha anode (lambda = 1.5405 A).3
powder XRD with Cu Kalpha radiation3
PXRD and MicroED/Pawley structural analysis3
Synchrotron PXRD, Rietveld refinement and CIF/checkCIF analysis3
Synchrotron PXRD with Rietveld refinement3
Powder X-ray diffraction with Rietveld refinement3
X-ray powder diffraction (XRPD), Bruker D8 ADVANCE, Cu Kalpha radiation3
SEM, TEM, HR-TEM, SAED, elemental mapping, XRD3
single-crystal X-ray diffraction with Mo Kalpha radiation3
Single-crystal X-ray diffraction; Mo Kalpha radiation; OLEX/SHELXT/SHELXL refinement3
single-crystal X-ray diffraction, Oxford Diffraction Xcalibur Nova R, Cu-Kalpha radiation3
Le Bail refinement of PXRD3
X-ray diffraction, Cu K alpha 1.5408 A, Bruker3
Powder X-ray diffraction (Cu K-alpha)3
PXRD and Rietveld refinement3
Powder X-ray diffraction and lattice-parameter simulation3
Powder XRD, Cu Kalpha radiation3
single-crystal X-ray diffraction; Mo Kalpha radiation3
PXRD / XRD3
Powder X-ray diffraction (XRD, Philips PW-1710)3
PXRD with Pawley refinement against DFT-optimised stacking models3
thin-film X-ray diffraction and SEM cross-section/top-view microscopy3
Single-crystal X-ray diffraction, Mo-Kalpha radiation, Rigaku Oxford diffractometer3
Single-crystal X-ray diffraction, Bruker SMART APEX II, Mo-Kalpha radiation3
single-crystal X-ray diffraction; Rigaku (Cu) X-ray DW diffractometer3
PXRD profile fitting with simulated structures3
Powder X-ray diffractometric trace analysis; Rh-Rh distance quoted from ref 43
Single-crystal X-ray diffraction; CIF deposited with CCDC3
PXRD before/after heating3
XRD using Bruker-AXS diffractometer3
X-ray diffraction (XRD-70003KW)3
PXRD before and after NFZ photocatalysis3
Powder X-ray diffraction of solution-deposited crystallites3
PXRD, FT-IR, Raman, XPS and TGA characterisation3
Powder XRD with Pawley refinement3
PXRD after air exposure2
Powder X-ray diffraction (PXRD), Bruker D8, Cu Kalpha1,22
TGA and post-soak PXRD2
in-situ VT-PXRD2
PXRD and SEM2
PXRD, TEM, SAED, AC-HRTEM, SEM and AFM.2
Synchrotron PXRD Rietveld refinement2
Powder X-ray diffraction and Rietveld refinement2
Powder X-ray diffraction, Bruker Advance II, Ni-filtered Cu Kalpha radiation2
PXRD after solvent immersion2
single-crystal X-ray diffraction (Mo Kalpha)2
single-crystal X-ray diffraction; Bruker SMART APEX II, Mo Kalpha, ShelXT/Olex2/ShelXL2
powder X-ray diffraction, Bruker D8 Advance, Cu Kalpha2
single-crystal X-ray diffraction, Bruker SMART APEX II, Mo Kalpha radiation, SHELX-972
PXRD and cRED2
Thermogravimetric analysis and variable-temperature PXRD2
out-of-plane XRD2
Single-crystal X-ray diffraction on Bruker SMART APEX II CCD with Mo Kalpha radiation at 298 K.2
Single-crystal X-ray diffraction; Bruker-AXS D8 Venture Kappa Duo; Mo Kalpha radiation; SHELX/JANA2020 refinement2
GIWAXS and SEM2
GIWAXS, SEM and AFM2
Powder X-ray diffraction using Cu K-alpha radiation.2
Powder XRD with Rietveld refinement2
PXRD after solvent soaking2
Single-crystal X-ray diffraction; Mo Kalpha radiation; SHELX refinement2
XRD and SAED2
Powder X-ray diffraction (PXRD), Bruker D8 ADVANCE, Cu Kalpha radiation2
Synchrotron powder X-ray diffraction reanalysis with DIFFaX stacking-fault modelling2
Single-crystal X-ray diffraction on Bruker D8 Liquid diffractometer with PHOTON 100 CMOS, Ga-K alpha radiation.2
Synchrotron powder X-ray diffraction with Rietveld refinement2
single-crystal X-ray diffraction; Bruker SMART APEX II, Mo Kalpha radiation; SHELX-97 refinement2
Powder X-ray diffraction with Cu Kalpha source2
Powder X-ray diffraction in reflection geometry; March-Dollase preferred-orientation analysis.2
Powder X-ray diffraction on Bruker D8 Advance with Cu Kalpha radiation.2
Powder X-ray diffraction (PXRD), Bruker D8 Discover, Cu Kalpha2
Single-crystal X-ray diffraction (SCXRD), Mo Kalpha, SHELXL-2016/62
Single-crystal X-ray diffraction; selected bond angles tabulated in Supporting Information2
Single-crystal X-ray diffraction; selected bond lengths tabulated in Supporting Information2
Single-crystal X-ray diffraction on Siemens Smart/CCD area-detector diffractometer; Mo Kalpha radiation; SADABS absorption correction; SHELXS-97/SHELXL-972
PXRD with Cu K-alpha radiation2
single-crystal X-ray diffraction (SC-XRD)2
PXRD stability tests2
variable-temperature PXRD2
single-crystal X-ray diffraction (Mo-Kalpha, 150 K)2
Single-crystal X-ray diffraction on Bruker-AXS SMART APEX II with graphite monochromated Mo-Kalpha radiation; SHELXT/SHELXL refinement2
single-crystal X-ray diffraction; SHELX refinement; PLATON SQUEEZE2
Single-crystal X-ray diffraction, Bruker SMART APEX II, Mo Kalpha radiation2
single-crystal X-ray diffraction on Rigaku AFC-7R using Mo Kα radiation2
Single-crystal X-ray diffraction (SXRD)2
PXRD and crystallographic structure comparison2
PXRD with Le Bail fitting2
Powder X-ray diffraction using Rigaku Miniflex system with CuKalpha radiation.2
Single-crystal X-ray diffraction using Bruker AXS APEX CCD with graphite-monochromated Mo Kalpha radiation; SHELXS-97/SHELXL-97 refinement.2
SEM and X-ray diffraction of MOF-sensitised TiO2 photoanode2
Powder XRD before and after water splitting2
Powder X-ray diffraction (PANalytical Xpert-Pro, Cu K alpha, lambda = 1.5406 A)2
powder X-ray diffraction, Rigaku SmartLab, Cu Kalpha radiation2
powder X-ray diffraction plus thermogravimetric analysis2
single-crystal X-ray crystallography, Bruker Apex CCD, graphite-monochromated Mo Kalpha radiation2
PXRD after THF exchange and evacuation2
Powder X-ray diffraction and Pawley refinement2
powder X-ray diffraction on Rigaku Smartlab, Cu Kalpha radiation2
Synchrotron PXRD2
Powder X-ray diffraction; Rigaku Miniflex with CuKalpha radiation (lambda = 1.54059 A).2
Single-crystal X-ray diffraction; Bruker D8-QUEST, graphite-monochromatic Mo-Kalpha radiation; SHELXS-2013/SHELXL-2013 refinement.2
single-crystal X-ray diffraction; Bruker SMART APEX II; SHELXT-2014/5 refinement2
PXRD, FT-IR, XPS2
In-plane grazing-incidence X-ray diffraction (GIXRD), Cu-Kalpha radiation2
Synchrotron XRPD Rietveld refinement2
Synchrotron XRPD, simulated annealing and GSAS-I Rietveld refinement2
GIWAXS at SSRL beamline 11-3, 12.7 keV, incidence angle 0.18 deg2
GIXRD line scan2
SEM and thin-film XRD2
Powder X-ray diffraction on SmartLab 9 kW diffractometer using Cu Kalpha radiation2
SEM and XRD growth series2
Single-crystal X-ray diffraction; structure solution/refinement2
powder X-ray diffraction with Cu Ka radiation2
PXRD and FTIR2
GI-WAXS2
single-crystal X-ray diffraction; Bruker SMART APEX II; Mo Kalpha radiation; SHELX-97/SHELXL refinement2
SEM/EDX, Raman and PXRD2
X-ray diffraction (X'Pert Pro MPD)2
powder X-ray diffraction, Rigaku D/M-2200T, Cu Kalpha radiation2
single-crystal X-ray diffraction, Bruker APEX II, Mo Kalpha radiation2
XRD Scherrer analysis2
powder XRD with Pawley/Rietveld refinement2
XRD with Cu Kalpha; Rietveld refinement2
powder X-ray diffraction; experimental pattern compared with simulated pattern from single-crystal CIF data2
single-crystal X-ray diffraction; SHELXT/SHELXL refinement2
PXRD in reflection mode, CuKalpha1 radiation2
operando GIWAXS under RH air2
operando GIWAXS-Sensor with simultaneous resistance2
powder XRD (PANalytical Empyrean)2
synchrotron PXRD and Rietveld refinement2
PXRD and thermogravimetric analysis2
XRD and FTIR2
variable-temperature out-of-plane XRD2
X-ray diffraction (Ultima IV, Cu K alpha)2
XRD (Bruker D8 ADVANCE)2
PXRD with Williamson-Hall analysis; SEM morphology2
single-crystal X-ray diffraction; SHELX-97 refinement2
TGA and PXRD2
Powder X-ray diffraction; Bruker D8, Cu Kalpha radiation2
Single-crystal X-ray diffraction (SCXRD)2
SAXS2
GIXRD and SEM2
PXRD, Pawley refinement, SEM and HRTEM2
PXRD after thermal/solvent treatments and TGA2
FTIR and PXRD phase identification2
X-ray powder diffraction, D/MAX Ultima III2
X-ray diffraction, Cu Kalpha radiation2
PXRD with LeBail refinement2
ex situ FTIR, O 1s/Cu 2p/P 2p XPS, EPR, ex situ PXRD during cycling2
Powder X-ray diffraction (PXRD), Rigaku Multiflex, Cu K-alpha source2
VT-PXRD and solution-treated PXRD2
PXRD / structural assignment2
Powder X-ray diffraction, Cu-Kalpha radiation, Rigaku D/max 2500 PC2
Single-crystal X-ray diffraction on Bruker Smart Apex CCD, Mo-Kalpha radiation, lambda = 0.7107 Angstrom2
FTIR and powder XRD2
single-crystal X-ray diffraction and powder X-ray diffraction2
Powder X-ray diffraction (Bruker D8 Advance)2
XRD, Cu K-alpha radiation2
SC-XRD2
X-ray diffraction (Cu Kalpha, Rigaku Rint-2000)2
PXRD and Raman spectroscopy2
Cross-section SEM, TEM, HRTEM, selected-area electron diffraction and PXRD with DFT comparison1
PXRD and XPS of Cu3(HITP)2 from Cu(I) route1
PXRD and Cu 2p XPS of Cu(opd)2/Cu metal control1
Grazing incidence X-ray diffraction1
DFT geometry optimisation combined with Pawley refinement against synchrotron PXRD1
PXRD and N2 sorption after chemical/electrolyte exposure1
Synchrotron PXRD and Pawley profile fitting1
PXRD and N2 sorption after thermal treatment1
HRTEM/FFT plus synchrotron PXRD and Pawley refinement.1
Low-dose HRTEM with FFT and intensity-profile analysis; supporting PXRD.1
Synchrotron GIXRD and laboratory PXRD with Pawley refinement1
Structural-model inspection from GIXRD/DFT-derived topology1
PXRD after conductivity measurement1
PXRD and Pawley refinement1
SEM, AFM/HRAFM, TEM and GIWAXS1
PXRD comparison of activation states1
Powder X-ray diffraction Rietveld refinement in TOPAS Academic V61
PXRD / XRD, in-plane and out-of-plane geometries1
post-OER/ORR XRD and SEM1
PXRD-supported structural modelling1
PXRD before and after CV stability test1
PXRD; Bruker D2 phaser, CuKalpha radiation; Rietveld refinement using GSAS-II1
GIXRD; Rigaku Smartlab, CuKalpha radiation1
Operational X-ray stability and post-irradiation PXRD1
X-ray diffraction (XRD), Smartlab Rigaku1
PXRD of iodine-doped Cu3(HHTN)21
Synchrotron PXRD Pawley fit comparison for pristine Cu3(HAB)2 and HAB-treated MOF1
PXRD crystallinity comparison1
Synchrotron PXRD and laboratory PXRD; Pawley fit; FWHM from [010]/[100] diffraction peak1
Single-crystal X-ray diffraction and structure refinement1
PXRD after pH soaking1
Experimental and simulated PXRD of pristine and metalated Cu-HHTC1
Powder X-ray diffraction with Pawley refinement against simulated packing models1
PXRD and EDS of metalated Cu-HHTP control1
temperature/precursor synthesis screen by PXRD1
temperature-dependent synthesis screen by PXRD1
Synchrotron powder X-ray diffraction with Le Bail refinement1
Single-crystal X-ray diffraction and full-matrix least-squares refinement1
Powder X-ray diffraction (Bruker diffractometer, graphite-monochromatic Mo-Ka radiation)1
Simulated X-ray diffraction pattern in SI1
Synchrotron 2D-GIXRD reciprocal-space mapping1
Synchrotron micro-XRD line scan in grazing-incidence mode1
SEM and synchrotron micro-XRD of Ar-plasma-etched line patterns1
Powder X-ray diffraction after pretreatment/storage1
N2 sorption/BET at 77 K and PXRD1
Laboratory PXRD stoichiometry series1
Synchrotron powder X-ray diffraction and Pawley refinement1
Synchrotron PXRD with Pawley fitting and structural simulation1
Powder X-ray diffraction of synthesis optimisation products1
PXRD, Pawley fitting and structural fitting1
Dye adsorption, solvent dispersion and PXRD stability tests1
GSAS-II simulated PXRD structure model1
GSAS-II simulated PXRD and FEFF 9.0 XANES structure model1
Powder X-ray diffraction (PXRD), non-monochromated Cu Kalpha radiation1
Powder X-ray diffraction, Bruker D8 Advance, Cu Kalpha radiation1
Powder X-ray diffraction (PXRD), Cu Kalpha radiation.1
powder X-ray diffraction, Co Kalpha radiation1
X-ray diffraction after cycling1
Wide-angle X-ray diffraction1
Single-crystal X-ray diffraction with RIGAKU XtaLAB Synergy-i, Mo Kalpha radiation, 150(2) K1
Synchrotron powder X-ray diffraction under C2H2 dosing1
Synchrotron powder X-ray diffraction under C2H4 dosing1
Powder X-ray diffraction stability checks1
Single-crystal X-ray diffraction with Mo Kalpha radiation on Bruker-AXS X8 Kappa Duo / Smart APEX II CCD1
Synchrotron XRD1
Powder X-ray diffraction with Le Bail refinement; synchrotron PXRD and Cu K-alpha PXRD.1
Thermogravimetric analysis and temperature-dependent PXRD.1
PXRD and variable-temperature PXRD1
Pawley refinement of pXRD using MicroED CIF1
Powder XRD comparison1
Synchrotron powder XRD and Rietveld refinement1
PXRD and SEM after solvent immersion1
X-ray diffraction and SAED1
Powder X-ray diffraction with Bruker D8 Advance, theta/2theta Bragg-Brentano geometry, nickel-filtered Cu Kalpha radiation1
powder X-ray diffraction with Pawley refinement and simulated stacking patterns1
Grazing incidence X-ray diffraction (GIXRD), Rigaku Smartlab, Cu K alpha, lambda = 1.5406 A1
GIXRD before and after PMMA transfer1
RDE three-electrode OER/ORR LSV, CV, EIS and chronoamperometry; post-test SEM/TEM/PXRD/FT-IR1
X-ray diffraction (XRD), Bruker D8 advance with Cu Ka radiation1
PXRD (Bruker D8 Advance, Cu Kalpha) and synchrotron GIXRD/GIWAXS (lambda = 1.24 A, BL14B)1
Powder XRD and grazing-incidence XRD; Rietveld refinement1
PXRD Pawley fitting, HRTEM/FFT and structural comparison1
Powder X-ray diffraction (PXRD) and profile fitting1
X-ray diffraction with simulated patterns1
PXRD/XRD with Cu Kalpha radiation1
synchrotron grazing-incidence XRD and out-of-plane XRD1
synchrotron in-plane and out-of-plane XRD1
GIXRD with Cu Kalpha X-ray source plus IR comparison1
Powder X-ray diffraction of crushed single crystals and calculated PXRD comparison.1
Elemental microanalysis, FT-IR, PXRD and TG-DSC/DTA general characterisation.1
powder X-ray diffraction (PXRD) with Rietveld refinement1
PXRD before and after water soaking1
Supplementary XRD pattern comparison1
Chronoamperometry/chronopotentiometry durability and post-test XRD/TEM1
PXRD after air or water exposure1
AFM and GIWAXS of spin-coated films1
Powder X-ray diffraction with Le Bail fitting; nanorod pattern collected at PAL 9B for fitting1
Thermogravimetric analysis and heat-treatment PXRD1
N K-edge soft XAS and PXRD of acid-solution reprecipitates1
PXRD with Pawley fitting1
PXRD, SEM, ICP-OES, N2 sorption, DFT pore size distribution1
SEM and powder XRD1
XPS of Cu 2p plus PXRD of H2O2-doped 1ADCu1
PXRD and SEM characterization of control cMOFs1
Continuous humidity-dependent PXRD1
Laboratory powder X-ray diffraction1
PXRD with Rietveld refinement against DFT-optimised model1
Powder X-ray diffraction on Rigaku MiniFlex600 using Cu Kalpha radiation1
Single-crystal X-ray diffraction with Mo Kalpha radiation; structure solved by direct method and refined by full-matrix least squares using SHELXTL-20151
Powder X-ray diffraction (PXRD), Cu-Kalpha1
Single-crystal X-ray diffraction, Bruker SMART APEX II CCD, Mo Kalpha1
Synchrotron PXRD with Pawley/Rietveld refinement and laboratory PXRD1
Crystal-structure assignment from literature/simulated structure, PXRD comparison and SAED.1
SEM and PXRD before and after NH3 contact.1
Powder X-ray diffraction, Bruker D8 Discover, Cu-Kalpha radiation1
Single-crystal X-ray diffraction on Bruker SMART APEX II, Mo Kalpha radiation; SHELX-97 refinement1
Powder X-ray diffraction on scratched electrodeposited films1
XRD with Cu-Kalpha radiation and XPS1
Continuous GCD cycling stability and post-cycling SEM/EIS/XPS/XRD/FTIR checks1
Powder X-ray diffraction; Bruker D8; Ni-filtered Cu Kalpha radiation1
Synchrotron PXRD with DFT-optimised model and Rietveld refinement1
PXRD and SEM/element mapping for Ag4TXHQ series1
XRD and FTIR comparison1
SEM and PXRD1
GIXD on thin film and PXRD on powder scraped from films1
powder X-ray diffraction (PXRD), Cu Kalpha radiation1
single-crystal X-ray diffraction; Mo-Kalpha radiation; SHELXT/SHELXL2014/7 refinement1
Benchtop powder X-ray diffraction1
GIXRD with in-plane and out-of-plane scattering geometries1
Transmission XRD before/after washing and drying1
Grazing-incidence small-angle X-ray scattering (GI-SAXS)1
SEM, TEM, EDS mapping, and powder XRD1
Powder X-ray diffraction / Pawley-refined XRD1
SEM and GIWAXS1
XRD detector scan, SEM, AFM1
X-ray total scattering pair distribution function analysis.1
Powder X-ray diffraction.1
Synchrotron PXRD with Pawley fit1
Control CVD product inspection and XRD/photograph1
Synchrotron GIWAXS and XRD with Pawley refinement1
TEM, elemental mapping, GIXRD, FTIR and Raman1
Structural assignment from PXRD/literature structures1
GIWAXS/GISAXS and XRD1
Powder X-ray diffraction (Cu K alpha)1
Ex situ XRD after electrochemical states1
Powder X-ray diffraction (PXRD), Bruker D8 Advance, Cu Kalpha1 radiation1
high-resolution powder X-ray diffraction (XRD; Smartlab, Rigaku)1
Powder X-ray diffraction with Pawley refinement and Materials Studio structure simulation1
grazing incidence X-ray diffraction (GIXRD)1
Powder X-ray diffraction (PXRD/XRD), Cu Kalpha1
Structural assignment from X-ray crystallography and literature Ni-CAT crystallographic model1
Powder X-ray diffraction (PXRD), Cu Kalpha source1
Powder x-ray diffraction (PXRD), synchrotron angle dispersive mode, lambda = 0.61 A1
Ex-situ XRD before and after NO2 exposure1
Powder X-ray diffraction (XRD), Cu K-alpha, lambda = 1.5418 A1
X-ray diffraction (MiniFlex2, Cu Kalpha, 2theta 4-20 deg, 0.5 deg min-1)1
Powder X-ray diffraction and thermogravimetric analysis1
Single-crystal X-ray diffraction on Bruker SMART APEX II with Mo Kalpha radiation; SHELX-97 refinement1
Post-cycling XRD and SEM1
Powder X-ray diffraction time-course for solvent-free SCSC transformation1
PXRD air-stability comparison1
XRD and Raman spectroscopy1
Powder X-ray diffraction (Bruker D8 Advance, Cu Kalpha, lambda = 1.54178 A)1
Powder X-ray diffraction, Bruker Focus D8, Cu Kalpha radiation (lambda = 1.54 A)1
Thermogravimetric analysis under air flow; residue identified by XRD as NiO1
XRD and GIWAXS1
powder X-ray diffraction compared with simulated single-crystal pattern1
Literature structure assignment for PCN-700 / PCN-703 scaffold; PXRD confirmation for prepared PCN-7001
Powder X-ray diffraction with Le Bail refinement; Rigaku diffractometer with Cu Kalpha source1
PXRD stability check after water and air exposure1
High-resolution powder X-ray diffraction1
ex situ PXRD during discharge-charge1
In situ PXRD under humid air/vacuum cycling with Le Bail refinement1
Ex situ PXRD after humidity/thermal treatment1
SC-XRD structural analysis and shortest S...S distance comparison1
Powder X-ray diffraction (PXRD), Rigaku D-MAX 25501
Single-crystal X-ray diffraction with Bruker Smart Apex II CCD, Mo Kalpha radiation; SHELXTL refinement; PLATON/SQUEEZE for guest-free refined structure1
PXRD of dropcast films after sonication1
Powder X-ray diffraction, Bruker D8 Advance, Cu radiation.1
Single-crystal X-ray diffraction; Me2NH2@1 listing taken from literature in Table S1.1
Single-crystal X-ray diffraction using Bruker SMART APEX II with graphite-monochromated Mo Kalpha radiation1
Synchrotron powder X-ray diffraction indexing1
XRD before/after field-emission test1
X-ray diffraction (XRD with Cu Kalpha; Empyrean)1
Single-crystal X-ray diffraction; Bruker SMART CCD diffractometer with graphite-monochromated Mo Kalpha radiation1
Single-crystal X-ray diffraction using Rigaku Mercury70 diffractometer with graphite-monochromated Mo-Kalpha radiation1
powder X-ray diffraction; Bruker D8 Advance, Cu Kalpha radiation1
XRD, FT-IR, ICP-OES and XPS characterisation1
PXRD after acid/base soaking1
PXRD after beta/gamma irradiation1
Post-NRA SEM, XRD and XPS stability characterisation1
PXRD with Cu Kalpha radiation; simulated patterns compared for AA/eclipsed and AB/staggered stacking.1
PXRD before and after CO2 capture/release cycling1
SEM and XRD of perovskite films1
temperature-dependent single-crystal X-ray diffraction1
Single-crystal X-ray diffraction (SC-XRD), Bruker APEX-II diffractometer, Mo Kalpha radiation, CCD detector; SADABS, SAINT, SHELXL, Apex III, Olex2, SHELXT1
PXRD after chemical exposure1
Le Bail fitting of PXRD patterns in GSAS-II1
PXRD Scherrer analysis and SEM particle sizing1
PXRD Scherrer analysis and selected SEM particle sizing1
SEM particle sizing and PXRD Scherrer analysis1
single-crystal X-ray diffraction; Rigaku AFC7R diffractometer with graphite-monochromated Mo-Kalpha radiation and CCD detector1
powder X-ray diffraction with Bruker D8 Advance, Cu K alpha radiation1
powder X-ray diffraction of pressed pellets after electrical measurements1
Ex situ XRD1
X-ray diffraction (Shimadzu-7000)1
powder X-ray diffraction (Cu Kalpha)1
Single-crystal X-ray diffraction on SuperNova AtlasS2 with monochromatic Cu Kalpha radiation; solved with ShelXT/Olex2.1
Single-crystal X-ray diffraction on Bruker SMART APEX II with graphite-monochromated Mo Kalpha radiation; solved with ShelXT 2014/4.1
Out-of-plane XRD, in-plane XRD and GIWAXS1
Unencapsulated ageing stability by XRD and photoresponse1
Experimental and simulated powder XRD comparison1
Temperature-resolved powder XRD, Panalytical Empyrean1
Post-OER XRD/XPS1
X-ray powder diffraction pattern matching1
Powder X-ray diffraction (Cu Kalpha, Bruker D8 ADVANCE)1
powder/rod X-ray diffraction1
XRD/PXRD pattern of drop-cast thin film1
Single-crystal X-ray diffraction and crystallographic refinement1
single-crystal X-ray diffraction on Bruker SMART APEX II, Mo Kalpha radiation; SHELX-97 refinement1
GIWAXS at DESY beamline P081
TGA and post-CO2RR PXRD1
SC-XRD-derived pore description1
powder X-ray diffraction (PXRD), Bruker D8 Discover, Cu K-alpha radiation1
single-crystal X-ray diffraction (SCXRD), Bruker SMART APEX III, Mo K-alpha radiation, SHELX-97 refinement1
single-crystal X-ray diffraction / CIF1
PXRD after electrolyte soaking1
continuous rotation electron diffraction (c-RED), PXRD Pawley/Rietveld refinement1
Powder X-ray diffraction, Rigaku Dmax, Cu-Kalpha radiation1
out-of-plane and in-plane X-ray diffraction; Cu Kalpha radiation, Rigaku SmartLab, five-axis goniometer1
out-of-plane and in-plane X-ray diffraction1
GIXRD / in-plane XRD / HRTEM1
SEM, XRD, Williamson-Hall analysis and UV-vis/Tauc1
thin-film XRD and grazing-incidence XRD (GIXRD)1
PXRD with Cu-Kalpha radiation1
Powder X-ray diffraction, Cu Kalpha1
OER chronopotentiometry durability with post-test PXRD/XPS/TEM1
Single-crystal X-ray diffraction; SHELXT/SHELXL refinement1
Single-crystal X-ray diffraction; SHELXT/SHELXL refinement; PLATON SQUEEZE1
Single-crystal X-ray diffraction; SHELXT/SHELXL refinement; PLATON SQUEEZE and OLEX2 model fitting1
Single-crystal X-ray diffraction; Rigaku Supernova CCD with Cu Kalpha radiation; SHELXTL/SHELXT refinement; PLATON SQUEEZE for disordered solvent1
PXRD / powder diffractogram1
Water-vapour cycling followed by PXRD1
IR spectroscopy and PXRD control characterisation1
XRD before and after 150 degC heating1
PXRD with Rigaku Smartlab 9 kW, Cu Kalpha radiation1
Single-crystal X-ray diffraction; SHELXTL-97 refinement; PLATON SQUEEZE for guest molecules1
PXRD comparison1
thin-film powder X-ray diffraction (PXRD)1
powder X-ray diffraction (Rigaku RINT2500)1
SEM and powder XRD of Co-MOF precursor1
powder XRD indexing / Le Bail profile fitting1
chemical oxidation-reduction followed by FTIR and PXRD1
PXRD after humidity exposure and dark-current comparison after ambient storage1
Powder X-ray diffraction (PXRD), Bruker D8 Advance, Cu Kalpha1
Single-crystal X-ray diffraction on Rigaku FR-X microfocus diffractometer; Mo Kalpha radiation; Olex2 refinement1
Powder X-ray diffraction; Crysfire indexing1
PXRD stability tests after immersion/solvent exposure and variable-temperature PXRD1
Powder X-ray diffraction (PXRD), Bruker Advanced II, Ni-filtered Cu Kalpha radiation1
Single-crystal X-ray diffraction, Bruker D8/APEX-II CCD with Cu Kalpha radiation; SHELXT/SHELXL refinement with SQUEEZE1
Powder X-ray diffraction with Cu Kalpha radiation; simulated patterns calculated with Material Studio Forcite and Mercury1
Pawley refinement of experimental PXRD patterns1
Post-electrochemical HR-TEM and XRD1
Single-crystal X-ray diffraction; Bruker D8-Venture with Mo Kalpha radiation in main text; CIF reports Bruker apex II, MoKalpha, SHELXL-2014/7 refinement1
Powder X-ray diffraction (XRD), Cu K-alpha radiation1
Grazing incidence X-ray diffraction (GIXD)1
Post-electrolysis PXRD and XPS1
Powder X-ray diffraction (PXRD), Rigaku MiniFlex600, Cu-Kalpha1
PXRD stability test after soaking1
Powder X-ray diffraction, SmartLab-3 kW; simulated and experimental comparisons in SI Figure S11
SI XRD impurity estimate and GCD control1
Post-soaking XRD, N2 adsorption, and FT-IR1
Out-of-plane and in-plane XRD1
Powder X-ray diffraction, Rigaku D/Max-2400, Cu Kalpha radiation1
PXRD, FT-IR, solid-state 13C NMR, XPS, SEM/TEM1
Powder X-ray diffraction with simulated and Pawley-refined profiles1
Powder XRD using Cu K alpha radiation1
Post-H2S XPS, Cu-AES, SEM-EDX, XRD, and FTIR1
Single-crystal X-ray diffraction; direct-method solution and SHELX refinement1
hydrogen-bond distance analysis from SCXRD-derived structures1
single-crystal X-ray diffraction on Rigaku AFC-7R using graphite-monochromatic Mo Kα radiation1
XRPD using Bruker D8 ADVANCE, Cu Kα radiation1
High-resolution multi-temperature synchrotron PXRD1
cRED / MicroED and PXRD Pawley fitting1
PXRD, SEM, SEM-EDX, ICP-OES, cross-sectional SEM, XPS1
Post-electrolysis PXRD, SEM, and SEM-EDX1
X-ray diffraction comparison to solvothermal HKUST-11
X-ray diffraction, PANalytical Empyrean, Cu Kalpha, 45 kV and 40 mA1
TGA, variable-temperature PXRD, soaking PXRD1
ex situ PXRD, FTIR, N 1s/O 1s/Cu 2p XPS after discharge/charge states1
PXRD with Pawley/Rietveld refinement of Cu-CuOAPc; comparison to AA-eclipsed, AA-inclined, AB-staggered and AB-partially staggered models1
PXRD (001) peak position converted to stacking distance1
PXRD before and after X-ray exposure1
Temperature-dependent PXRD1
Powder X-ray diffraction comparison1
XRPD comparison with simulated patterns1
Synchrotron XRPD with Le Bail fitting, SPring-8 BL44B2, lambda = 0.80014 A1
Powder X-ray diffraction (Rigaku MiniFlex600, Cu Kalpha) in air1
X-ray diffraction, D8-Advance Bruker AXS, Cu Kalpha radiation, theta/2theta geometry1
SEM, TEM, XRD, N2 BET1
SEM, TEM, XRD1
SEM, TEM, XRD, Raman spectroscopy1
X-ray diffraction (PANalytical X'PERT Pro)1
Powder X-ray diffraction using Cu Kalpha source1
Full-range powder XRD and lattice/d-spacing summary1
powder X-ray diffraction / synchrotron out-of-plane XRD1
powder X-ray diffraction pattern matching1
single-crystal X-ray diffraction and structure refinement1
Grazing-incidence X-ray diffraction, in-plane and out-of-plane1
Water immersion stability test with XRD and SEM1
Powder X-ray diffraction after grinding1
High-pressure single-crystal X-ray diffraction and Birch-Murnaghan EoS fitting1
X-ray diffraction (XRD, X'Pert3 Powder, PANalytical)1
Post-reaction XRD, SEM, HRTEM, HAADF-STEM, EDS mapping and XPS1
Post-cycling SEM, TEM, PXRD and XPS1
PXRD after solvent/chemical soaking1
PXRD with structure simulation/Rietveld refinement1
Powder X-ray diffraction (XRD), Cu Kalpha radiation, SEIFERT PTS 30031
PXRD, D/max 2500 VL/PC, graphite monochromated Cu Kalpha radiation1
post-OER PXRD1
Out-of-plane XRD, in-plane XRD, azimuthal phi scan, and in-plane RSM1
Photo imaging, SEM, and XRD confirmation of patterned oriented Cu3(BTC)21
powder X-ray diffraction (XRPD), Panalytical XPert Powder with Cu Kalpha irradiation1
grazing-incidence powder X-ray diffraction (PXRD)1
Powder X-ray diffraction with simulated M-NMN comparison1
Powder X-ray diffraction (Cu Kalpha radiation)1
X-ray diffraction (XRD), Cu Kalpha radiation1
SEM and powder X-ray diffraction1
post-electrolysis UV-vis, CV, PXRD, DRIFTS, and TEM-EDS stability checks1
Powder X-ray diffraction (PXRD), Cu Kalpha1 radiation1
Single-crystal X-ray diffraction; structure solved/refined using DENZO, SCALE-PACK, SHELXTL-PLUS and SHELXL-971
Crystal-structure interpretation from single-crystal X-ray diffraction1
powder X-ray diffraction (PXRD), Cu-Kalpha radiation1
ex situ XRD, SEM, TEM/HRTEM, and SAED1
SEM, PXRD, and N2 sorption/BJH porosity1
Powder X-ray diffraction in reflection mode; Inel Equinox 1000; monochromated Cu-Kalpha radiation, lambda = 1.5406 A1
Single-crystal X-ray diffraction; Bruker Smart Apex CCD; Mo Kalpha radiation, lambda = 0.71073 A; SMART/SAINT/SADABS; SHELXL 6.14 refinement1
Powder X-ray diffraction (Cu Kalpha, lambda = 1.5406 A)1
Powder X-ray diffraction (XRD/PXRD) with Pawley refinement1
Aqueous dispersion observation and PXRD after soaking in Milli-Q water1
FT-IR, Raman and XRD1
moisture ageing photographs, UV-vis and XRD1
PXRD after solvent/acid/base soaking1
Laboratory powder X-ray diffraction (PXRD)1
Post-cycling XRD, TEM and SAED1
single-crystal X-ray diffraction on Bruker D8 VENTURE with Mo-Kalpha radiation; SHELXS/SHELXL refinement; CIF CCDC 20183111
single-crystal X-ray diffraction on Bruker D8 VENTURE with Mo-Kalpha radiation; SHELXS/SHELXL refinement; CIF CCDC 20183121
single-crystal X-ray diffraction; CIF from CCDC 20183101
powder X-ray diffraction with Cu-K(alpha) radiation1
PXRD with Pawley refinement; simulated AA/AB stacking models1
Post-cycling FTIR, PXRD, SEM, and TEM1
Supplemental XRD, SEM, and TEM-SAED on dried/cycled Co1/2Fe1/2-MOF electrode materials1
Powder X-ray diffraction (PXRD/XRD), Bruker D8 Advance, Cu-Ka radiation1
Thermogravimetric analysis and residual XRD1
SEM, TEM, XRD, STEM-EDX1
Chronopotentiometry stability test with post-test SEM, EDX and XRD1
FT-IR, XRD and XPS survey spectra1
Powder X-ray diffraction (D8 DISCOVER A25)1
SI XRD, FT-IR, SEM and TEM rendered-page review1
2D grazing-incidence wide-angle X-ray scattering (GIWAXS)1
Single-crystal X-ray diffraction, Bruker APEX-II CCD, Mo Kalpha radiation1
FTIR and powder X-ray diffraction1
Powder XRD and Le Bail refinement1
Powder XRD with Cu-Kalpha radiation; Le Bail refinement for lattice parameters1
Powder XRD ageing stability comparison1
Powder XRD and structural assignment1
Thin-film XRD1
Powder XRD and FE-SEM1
SEM, TEM, EELS elemental mapping, and powder XRD1
XRD, FTIR, SEM, TEM/EDS, TGA, ICP, XPS, Raman, BET1
X-ray diffraction spectroscopy (XRD)1
single-crystal X-ray diffraction partially solved, then DFT optimisation for disordered pyrrolidine-ring coordinates1
Ex-situ XRD, SEM, and dissolution observation of cycled electrodes1
Literature crystallographic comparison and simulated XRD reference1
Powder XRD with Le Bail refinement1
Out-of-plane theta-2theta XRD using Bruker D8 Advance with Cu anode, lambda = 0.154 nm1
High-resolution synchrotron PXRD Rietveld refinement1
Single-crystal X-ray diffraction; Rigaku FR-X Cu-Kalpha, CrysAlisPro, SHELXL/Olex2 refinement1
Single-crystal X-ray diffraction; Bruker D8 Venture / PHOTON-100 CMOS, Mo Kalpha; SHELXTL refinement with PLATON SQUEEZE1
Single-crystal X-ray diffraction on a CAD-4 diffractometer with graphite-monochromated Mo Kalpha radiation1
Synchrotron PXRD with Pawley refinement1
PXRD of THQ-containing control attempts1
PXRD after electrical impedance spectroscopy1
SEM, TEM, XRD and FTIR1
SEM/TEM and XRD during sulfidation evolution1
Powder X-ray diffraction (PXRD, Empyrean Panalytical, Cu Kalpha, 40 kV, 40 mA)1
Grazing-incidence PXRD, SEM, and XPS1
Supplementary single-crystal X-ray crystallographic tables for CP 1 and CP 2.1
powder X-ray diffraction; Bruker D8 ADVANCE1
Rietveld refinement of XRD1
Grazing-incidence X-ray diffraction and scanning electron microscopy1
Ex situ PXRD, FTIR and XPS after charge/discharge1
In situ TG-FTIR, XRD, UV-vis and GIWAXS1
powder X-ray diffraction comparison1
Powder X-ray diffraction comparison with calculated pattern1
XRD, UV-vis and XPS characterisation of Co3HHTP2 control film1
PXRD, synchrotron PXRD, TEM/FFT and HAADF-STEM1
PXRD after acid/base water stability exposure1
X-ray pair distribution function (PDF)1
Single-crystal X-ray diffraction of ReO4-loaded ZJU-X61
Single-crystal X-ray diffraction of 99TcO4-incorporated ZJU-X61
TEM-EDS mapping, FT-IR, TGA and PXRD after ReO4- sorption1
XRD and XPS1
In-house X-ray powder diffraction (XRPD), Rigaku SmartLab, Cu K-alpha line1
Maximum entropy method electron-density visualisation from synchrotron XRPD1
ex situ PXRD, FTIR and XPS of pristine, lithiated and delithiated anodes1
Small-angle X-ray scattering (SAXS)1
PXRD with Le Bail fitting; Cu Kalpha radiation1
EDS, XPS, EPR, TGA and post-soaking PXRD stability checks1
powder X-ray diffraction compared with simulated pattern1
single-crystal X-ray diffraction, Bruker SMART APEX II, Mo Kalpha radiation1
X-ray diffraction (XRD, PANalytical)1
single-crystal X-ray diffraction after iodine treatment1
Powder X-ray diffraction (XRD), Shimadzu Lab X/XRD-6000, Cu Kalpha1
Powder X-ray diffraction (XRD), Cu Kalpha1
Powder X-ray diffraction and Rietveld refinement; Bruker D8 Advance, Cu Kalpha = 0.15418 nm, GSAS II.1
Single-crystal X-ray diffraction; Bruker D8 Venture PHOTON III, Mo Kalpha radiation; SHELXT/SHELXL 2019/1 refinement.1
Ex situ XRD during first charge-discharge cycle1
X-ray diffraction (XRD) and crystal-structure model1
Lithiation/de-lithiation site assignment from XPS and ex situ XRD1
Powder X-ray diffraction and TEM1
Ex situ time-lapse XRD and TEM after chronoamperometric CO2RR1
Single-crystal X-ray diffraction (SC-XRD), decreasing-temperature run1
Single-crystal X-ray diffraction (SC-XRD), XtaLAB Synergy-S1
XRD pattern calculated from SC-XRD and compared with simulated ZIF-81
XRD/SAED/TEM1
Temperature-dependent XRD and TG/DTG1
Powder X-ray diffraction; Pawley refinement1
FTIR, PXRD, TEM/HRTEM, SAED, AFM, SEM, Tyndall effect1
FTIR, PXRD, SEM, TEM, AFM, Tyndall effect, ICP-AES1
PXRD, ATR-FTIR, SEM, TEM/HRTEM, EDX1
Powder X-ray diffraction with Cu Kalpha radiation, 0.02 degree step1
Powder X-ray diffraction from rendered SI Figure S11
Powder XRD and small-angle XRD1
Powder X-ray diffraction using CuKa radiation1
XRD, FT-IR and SEM after GA/DNA modification1
PXRD with BRUKER D8 Venture and SEM with Magellan 400 XHR1
Thin-film X-ray diffraction and structural modelling1
Single-crystal X-ray diffraction on Bruker SMART diffractometer; Mo Kalpha radiation; SHELX/Olex2 refinement1
Single-crystal X-ray diffraction on Bruker SMART diffractometer; radiation wavelength listed in SI; SHELX/Olex2 refinement1
Powder X-ray diffraction on Bruker D8 with Cu Kalpha radiation; simulated pattern from single-crystal CIF using CCDC Mercury1
Single-crystal X-ray diffraction; Oxford Diffraction X-Calibur with Mo Kalpha radiation; SHELXS-97/SHELXL-2016 refinement1
X-ray diffraction (Rigaku Miniflex600)1
SEM, XRD and FT-IR1
SEM, EDX, XRD and FT-IR1
photography, SEM and XRD1
GIXRD / XRD with Williamson-Hall fitting1
Powder XRD/WAXS with Cu Ka radiation and SAED by TEM dark-field diffraction mode1
PXRD before and after heating1
PXRD peak full width at half maximum analysis1
PXRD after solvent exchange1
In situ variable-temperature PXRD under reduced pressure1
Variable-temperature PXRD under reduced pressure1
Powder X-ray diffraction (PXRD) with simulated PXRD comparison1
FTIR, XRD, TEM, SEM, EDS and XPS survey of M23(M13.HAHATN)2 variants1
Durability by repeated CV, chronoamperometry, post-test XRD/TEM/SEM1
Powder X-ray diffraction (XRPD)1
Powder X-ray diffraction using Cu K alpha radiation; comparison with simulated eclipsed AA and staggered AB models; Pawley refinement1
Powder X-ray diffraction before and after conductivity testing1
Powder X-ray diffraction; SI modulator series comparison1
in situ XRD during first cycle1
In-plane and out-of-plane X-ray diffraction1
Powder X-ray diffraction using Rigaku MiniFlex II with Cu K alpha 1 radiation1
XRD plus top-view and cross-section SEM1
Single-crystal X-ray diffraction refinement1
Single-crystal X-ray diffraction cell/reflection summary1
PXRD after water immersion1
PXRD and mass-loss observations after oxidative exposure1
PXRD, Rigaku D/MAX2550, Cu Kalpha, 2theta 4-40 deg, 6 deg min-11
single-crystal structure/literature structural description and PXRD assignment1
FT-IR and XRD after solvent/acid/base soaking1
Powder X-ray diffraction on Rigaku MultiFlex; comparison with Diamond-simulated patterns1
Single-crystal X-ray diffraction, Rigaku RA-micro7 Mercury CCD, Mo Kalpha1
Single-crystal synchrotron X-ray diffraction, Aichi Synchrotron Radiation Center BL2S11
Post-electrolysis PXRD, FT-IR, XPS and recycling electrolysis1
Single-crystal structure analysis and PXRD comparison for 3D In-MOF, In4 and In81
Powder X-ray diffraction (PXRD/XRD)1
Photocatalytic recycling experiment with post-reaction PXRD1
Variable-temperature powder X-ray diffraction1
PXRD, Cu sealed tube, 2theta 5-30 deg1
XRD of aged perovskite films1
X-ray diffractometry (XPert3, PANalytical)1
single-crystal X-ray diffraction; direct methods and full-matrix least-squares refinement with SHELXTL/SHELXL; PLATON/SQUEEZE for disordered solvent1
XRD, Raman and FTIR1
powder X-ray diffraction (XRD, 9 kW/SmartLab)1
Out-of-plane X-ray diffraction/GIXRD and powder XRD1
PXRD before and after electrical measurements1
Single-crystal X-ray diffraction (SCXRD/SXRD)1
Powder X-ray diffraction, Bruker D8 Advance1
Single-crystal X-ray diffraction; Bruker KAPPA APEX II CCD Duo; Mo Kalpha radiation; SHELXTL/SHELXL-97 refinement1
X-ray diffraction, Philips PW 3710, Cu Kalpha radiation1
Powder X-ray diffraction / PXRD1
IR, TG, PXRD, SEM and EDS mapping1
PXRD and FE-SEM of spent catalyst1
SCXRD-derived bond lengths and angles1
SCXRD hydrogen-bond contact analysis1
Powder XRD and grazing-incidence XRD1
Single-crystal X-ray diffraction (SCXRD), Bruker D8 Venture PHOTON III M14, Mo Kalpha radiation1
Single-crystal X-ray diffraction / CIF crystallographic refinement1
Powder X-ray diffraction (PXRD/XRPD)1
single-crystal X-ray diffraction after irradiation1
ICP-MS copper release, temperature monitoring, post-operation SEM/XRD1
SEM and XRD of Cu-HHTP NP-Cu1
Powder X-ray diffraction (PXRD), PANalytical Xpert, Cu Kalpha radiation1
Post-BA-oxidation IR, PXRD, SEM, TEM, EDX, XPS, HRTEM and SAED1
Powder X-ray diffraction with Rietveld refinement; Bruker D8-Advance Cu Kalpha; Materials Studio Powder Refinement with UFF energy fit1
Post-ORR SEM, XRD and XPS1
Out-of-plane XRD and grazing-incidence in-plane XRD1
X-ray diffraction (Cu K alpha)1
Ex situ XRD after discharge at varied humidity1
Ex situ XRD and SEM after discharge and recharge1
XRD with Cu Kalpha radiation1
Charge voltage profile and XRD of Li2CO3-preloaded electrodes1
Charge voltage profile and XRD of LiOH-preloaded electrodes1
PXRD after 0.1 M KOH chemical stability treatment1
powder X-ray diffraction (XRD, Rigaku D/Max-2550pc)1
X-ray diffraction (Cu K-alpha, lambda = 1.5418 A)1
Powder X-ray diffraction using Miniflex600, Cu-Kalpha radiation (lambda = 1.54056 Angstrom), reflection mode1
Powder X-ray diffraction using same Miniflex600 conditions as host PXRD1
Single-crystal X-ray diffraction; Agilent SuperNova, Cu-Kalpha radiation (lambda = 1.54184 Angstrom); SHELXL refinement1
Powder X-ray diffraction (PXRD) using Panalytical X'pert-Pro diffractometer1
Single-crystal X-ray diffraction (SXRD) using Bruker Kappa ApexII; SHELXL-2018/3 structure solution/refinement1
Williamson-Hall analysis of PXRD data1
Single-crystal X-ray diffraction; Bruker SMART APEX-II CCD; Mo Kalpha radiation1
Single-crystal X-ray diffraction (Bruker SMART APEX II, Mo Kalpha, SHELX)1
XRD, SEM, HRTEM, elemental mapping, ICP, XPS1
Single-crystal X-ray diffraction with Mo Kalpha radiation; structure solved with WINGX/SHELXS-97 and refined with SHELXL-971
PXRD with Pawley refinement against DFT-optimized AA-serrated model1
PXRD screening of synthetic products from solvothermal and liquid-liquid interfacial conditions1
Thermogravimetric analysis, solvent-immersion PXRD, salt-immersion PXRD/EDS and zeta potential1
Product yield and XRD/SEM for TMAH dilution series1
Single-crystal X-ray diffraction; powder XRD with Rietveld refinement1
Thermogravimetry and XRD of thermal remnant1
Photocatalytic cycling stability with PXRD/FTIR checks1
GIXRD / X-ray diffraction, Bruker D8 Advance, Cu Kalpha1
TGA/DSC with temperature-dependent PXRD1
in situ electrochemical XRD1
Single-crystal X-ray diffraction, Bruker SMART APEX II, Mo Kalpha radiation (lambda = 0.71073 A)1
X-ray diffraction using Bruker D8 Advance with Lynxeye detector in theta-2theta geometry and Cu Kalpha radiation1
PXRD and FTIR phase/functional-group checks1
In situ GIWAXS during H2/He annealing1
GIWAXS substrate-orientation comparison1
XRD and grazing-incidence wide-angle X-ray scattering (GIWAXS)1
XRD, nitrogen sorption and TGA1
Powder XRD of drop-cast CuAT film1
Powder XRD; Bragg-Brentano reflection and Debye-Scherrer capillary transmission; simulated annealing and Rietveld refinement1
Powder XRD indexing, Pawley refinement and preliminary simulated annealing1
XRD, Raman and Li 1s XPS after discharge/charge1
Powder X-ray diffraction using Rigaku D/Max 2500v/PC with Cu-Ka radiation1
SEM, EDX, XRD; FT-IR in Fig. S321
SEM and XRD; FT-IR in Fig. S381
In-plane and out-of-plane XRD; rocking curve; pole figure1
SEM and XRD; FT-IR in Fig. S351
SEM, EDX, XRD; FT-IR in Fig. S291
Ag electroplating test, SEM/EDX/XRD1
SEM, AFM and XRD over deposition time1
SEM and XRD of PCTE-template nanorods1
Ex situ XRD and SEM before/after charging and after cycling1
Powder X-ray diffraction (XRD, Empyrean Bruker D8)1
X-ray diffraction, out-of-plane and in-plane XRD1
PXRD after C60 infiltration1
powder X-ray diffraction (Bruker D8 Advance)1
GIWAXS/PXRD structural assignment1
GIWAXS orientation analysis1
grazing-angle GIWAXS1
operando GIWAXS-Sensor1
in-situ synchrotron PXRD1
PXRD/FT-IR/TGA stability tests1
ENRR cycling stability and post-cycle PXRD1
powder X-ray diffraction with Rietveld refinement using Fullprof1
single-crystal X-ray diffraction on SMART-CCD Bruker diffractometer; Mo Kalpha radiation; SHELXTL refinement1
Single-crystal X-ray diffraction/refinement1
single-crystal X-ray diffraction, Bruker APEX2 CCD area detector, Mo Kalpha radiation1
single-crystal X-ray diffraction, Bruker SMART/CCD area detector, Mo Kalpha radiation1
single-crystal X-ray diffraction; main experimental section describes Bruker APEX2, CIF lists Stoe IPDS for Tl1
synchrotron PXRD/Rietveld plus SEM/HRTEM after cycling1
Grazing-incidence X-ray diffraction (GIXRD) and Williamson-Hall analysis1
powder X-ray diffraction (Shimadzu XRD-6000, Cu Kalpha)1
XRD of perovskite film on TiO2/FTO1
Powder X-ray diffraction using Siemens D-5000, Cu Kalpha radiation, 40 kV, 30 mA1
Single-crystal X-ray diffraction; Bruker-Nonius Kappa CCD in main text and Bruker APEX-II CCD in CIF; Mo Kalpha radiation; SHELXL refinement1
Post-OER microscopy/XRD/XPS/XANES and in situ Raman1
powder out-of-plane X-ray diffraction (PXRD)1
Powder X-ray diffraction with Rietveld phase quantification1
Powder X-ray diffraction Rietveld refinement using SCXRD structural model1
Single-crystal X-ray diffraction; Bruker D8 QUEST; Mo-target X-ray tube; Olex2/ShelXT/ShelXL refinement1
X-ray diffraction (XRD), Bruker D8 Focus with Cu radiation1
XRD and UV-vis absorption1
X-ray diffraction and fast Fourier transform of HRTEM1
variable-pressure powder X-ray diffraction with Rietveld analysis1
PXRD before and after electrolysis1
Powder X-ray diffraction with Cu Kalpha radiation and Le Bail profile fitting1
Ex-situ XRD, FT-IR, XPS and HRTEM at lithiation/delithiation states1
PXRD after CV cycling/OER1
SEM cross-section/top-down imaging and grazing-incidence PXRD1
powder X-ray diffraction after chronoamperometry1
Single-crystal X-ray diffraction; crystallographic parameter table1
postmortem X-ray diffraction after LSV1
PXRD with pattern matching refinement1
PXRD-derived cell-parameter and cell-volume trend from SI Figure S21
PXRD of Zn-MOF-74 with different Na[EMIm][TFSI] loadings1
single-crystal X-ray diffraction / CIF refinement1
solvent stability PXRD1
Powder X-ray diffraction (D/MAX-3D diffractometer)1
Powder X-ray diffraction with Cu-Kalpha radiation, 40 kV, 30 mA1
Powder X-ray diffraction (PXRD), theta-2theta scan, Cu Kalpha radiation1
PXRD indexing, Pawley refinement, simulated annealing and Rietveld refinement1
Powder X-ray diffraction pattern for Zn2(bdc)2P1
Powder X-ray diffraction (PXRD), Rigaku Ultima IV1
powder X-ray diffraction; Rigaku diffractometer, Cu Kalpha1
PXRD after humidity exposure1
single-crystal X-ray diffraction; Rigaku SCX-MINI, Mo radiation1
PXRD and SAXS stability checks1
SAXS and cryo-STEM1
XRD before and after photocatalytic study1
Post-water-splitting SEM/XPS/XRD1
DFT geometry optimisation in VASP with PBE and PXRD simulation/profile fitting1
variable-temperature PXRD and solvent-soaking PXRD1
ex situ PXRD and XPS at selected charge/discharge states1
Powder X-ray diffraction (Cu Kalpha)1
PXRD before/after electrode fabrication and bulk electrolysis1
2D GIWAXS indexed with GIXSGUI1
single-crystal X-ray diffraction; Table S3 crystallographic refinement1
single-crystal X-ray diffraction comparison before and after hydrazine exposure; Table S41
single-crystal X-ray diffraction; Table S2 crystallographic refinement1
single-crystal X-ray diffraction; Bruker Kappa-APEXII, Mo-Kalpha, 200 K, SHELXT/SHELXL refinement1
Powder X-ray diffractometric trace analysis; Rh-Rh distance entry quoted from ref 41
Powder X-ray diffractometric trace analysis; Rh-Rh distances quoted from ref 41
PXRD with Le Bail refinement using Rietica1
Photocatalytic cycling stability with post-cycle XRD/FESEM/XPS1
Single-crystal/powder XRD structure assignment1
High-resolution multifunction X-ray diffractometer (D8 Discover Davinci)1
Single-crystal X-ray diffraction, Rigaku RAXIS RAPID, Mo-Kalpha radiation; SHELX97 refinement1
Single-crystal X-ray diffraction, Rigaku RAXIS RAPID, Mo-Kalpha radiation; SIR2008/SHELXL refinement1
Powder X-ray diffraction (PXRD), Bruker D2 PHASER, Cu Kalpha radiation1
Single-crystal X-ray diffraction (SXRD), Bruker APEX-II CCD, Mo Kalpha radiation1
post-electrolysis XRD/SEM/HRTEM1
XRD and SEM comparison of Co-HITP films in DMF and aqueous solvent1
Hall-Williamson analysis of PXRD peak broadening1
Powder X-ray diffraction using Bruker AXS D8 Advance diffractometer1
Single-crystal X-ray diffraction using Bruker AXS Kappa Apex2 CCD diffractometer1
powder X-ray diffraction, Cu Ka radiation1
rotation electron diffraction plus powder X-ray diffraction Rietveld refinement1
XPS and PXRD before/after chemical reduction1
GIXRD before and after chronoamperometry1
XRD/GIXRD using Bruker D8 ADVANCE, Cu Kalpha radiation1
TEM and GIXRD particle-size/crystallite-size analysis1
GIWAXS on ultrathin glass-supported films1
GIWAXS linecuts and 2D GIWAXS images1
Synchrotron grazing-incidence wide-angle X-ray scattering (GIWAXS)1
X-ray powder diffraction and Rietveld refinement1
Post-CO2RR PXRD, FT-IR, HR-TEM, EDS, XPS, Cu LMM Auger1
PXRD, HR-TEM/SAED, Pawley refinement1
Photocatalyst recycling followed by PXRD before/after fourth cycle1
X-ray diffraction (Rigaku SmartLab, Cu Kalpha radiation, lambda = 1.5418 A)1
Structural assignment from PXRD and MIL-100 framework model1
X-ray total scattering and PDF1
Single-crystal X-ray diffraction and powder X-ray diffraction/Pawley fitting1
SAED, AC-HRTEM, FFT, image simulation and GIWAXS1
Single-crystal X-ray diffraction structure analysis from prior report, discussed here1
post-test XRD and SEM on comparator electrodes1
PXRD and SEM of comparator frameworks1
post-test XRD/Raman/SEM/XPS1
PXRD; topological/structure assignment1
2D-GIWAXS of C10-DNTT on dielectric layers1
1D-XRD and 2D-GIWAXS1
out-of-plane and in-plane XRD1
Room-temperature out-of-plane XRD and Rietveld refinement1
In situ powder X-ray diffraction under CO21
In situ single-crystal X-ray diffraction1
ATR-FTIR and PXRD after nanoprocessing1
powder X-ray diffraction with Pawley refinement and simulated stacking models1
thermogravimetric analysis and chemical stability PXRD1
X-ray diffraction (XRD, Bruker D8 Advance)1
Powder XRD, TGA, XPS1
pXRD and SEM side-view imaging1
Post-TRTS pXRD1
Powder X-ray diffraction (pXRD), Rigaku SmartLab; calculated reference from Mercury/CCDC1
Powder X-ray diffraction with Rietveld refinement; CIF1
Powder X-ray diffraction with Cu source; Siemens D5005; simulated pattern from CCDC/Mercury1
Single-crystal X-ray diffraction; Bruker-Nonius APEX II CCD; ShelXS/ShelXL refinement; CCDC 15179231
Control-atmosphere SEM and PXRD1
Three-electrode GCD cycling stability and post-cycling PXRD1
High-resolution synchrotron XRD/PXRD1
Polysulfide adsorption test and post-adsorption XRD1
SEM and XRD of processed electrodes1
Post-cycling XRD stability comparison in LiPF6 and LiTFSI electrolytes1
In situ XRD during cyclic voltammetry1
Thermogravimetric analysis and PXRD residue check1
PXRD after MnO4- adsorption/exchange1
PXRD after pH/boiling-water treatment1
High-resolution synchrotron powder X-ray diffraction with simulated PXRD comparison1
Single-crystal X-ray diffraction on Bruker APEX II QUAZAR; SHELXT/SHELXL refinement in Olex2; PLATON/SQUEEZE solvent treatment1
PXRD of fresh Fe-HHTP electrode1
powder X-ray diffraction (Rigaku Smart Lab)1
ex situ XPS, FTIR, and XRD for lithiation/delithiation1
synchrotron X-ray diffraction1
Powder X-ray diffraction (PXRD), Cu target lambda = 1.5406 A1
Synchrotron powder X-ray diffraction with Pawley refinement; beamline O2B2 at SPring-81
IR spectroscopy and PXRD before/after NH3 exposure1
powder X-ray diffraction (Bruker D8 ADVANCE, Cu Kalpha)1
single-crystal X-ray diffraction (Bruker APEX II, Mo Kalpha); SHELXTL refinement1
XRD and HR-TEM of cycled cathodes1
Water immersion followed by XRD and coin-cell cycling1
crystal-structure assignment from PXRD/model and HRTEM1
XRD, FTIR, TGA1
XRD, Raman spectroscopy, and XPS1
X-ray diffraction with Cu K-alpha radiation1
Powder X-ray diffraction; in situ vacuum heat treatment; Pawley fit by TOPAS 4.21
crystal-structure assignment from XRD and model1
SEM and XRD after electrochemical cycling/soaking1
X-ray powder diffraction (XRD)1
Powder X-ray diffraction and Scherrer crystallite-size analysis1
Powder X-ray diffraction (XRD), Cu K alpha radiation.1
Synchrotron grazing-incidence X-ray diffraction1
electrode thickness, electrolyte solubility, PXRD chemical stability, post-cycling EIS/SEM1
Powder X-ray diffraction, Rigaku D/max-2200, Cu-Kalpha1
Synchrotron total scattering pair distribution function (PDF) and RDF1
Synchrotron powder X-ray diffraction with Pawley refinement1
Ex situ synchrotron PXRD, ATR FT-IR, XAFS, XPS, and SEM at charged/discharged states1
Single-crystal X-ray diffraction, Bruker smart APEXII CCD, Mo Kalpha radiation1
Powder X-ray diffraction; Rietveld refinement for Cu-DBCO; XRD comparisons for Cu/Ni and Cu95M5 series1
PXRD after immersion in ultrapure water1
Single-crystal X-ray diffraction crystallographic data table1
Single-crystal X-ray diffraction; CIF refinement1
Single-crystal XRD structural analysis1
SEM, XRD and FT-IR after air exposure1
PXRD chemical stability test1
PXRD/SXRD comparison and Table S1 distances1
SXRD/PXRD structural interpretation and Table S1 distances1
PXRD/XPS after H2O2 chemical stability tests1
Powder X-ray diffraction using Cu K alpha radiation1
Post-electrolysis PXRD1
Powder X-ray diffraction (Bruker D8 ADVANCE, Cu Kalpha, lambda = 0.154056 nm)1
Powder X-ray diffraction and structural simulation1
Powder X-ray diffraction (Anton Paar XRDynamic 500)1
SEM/AFM/XRD/XPS/contact angle/electronic conductivity tests1
3D SLCM, cross-sectional SEM, EDS mapping and XRD after cycling1
PXRD/FT-IR chemical stability tests1
PXRD with Pawley refinement and simulated AA-stacking pattern1
powder X-ray diffraction after potentiometric measurements1
Simulated XRD diffractogram1
XRD after immersion in pH 7.0-11.0 solutions1
Powder X-ray diffraction (PXRD), Panalytical X'pert PRO1
Single-crystal X-ray diffraction; Bruker smart APEXII CCD; Mo Kalpha radiation; SHELXL refinement1
Powder X-ray diffraction with Pawley fitting1
XRD and selected-area electron diffraction (SAED)1
PXRD with simulated XRD comparison; SAED plane assignment1
powder X-ray diffraction stability comparisons1
single-crystal X-ray diffraction; Bruker SMART APEX CCD; Mo Kalpha radiation1
PXRD after H2S exposure1
Powder/thin-film XRD1
Galvanostatic electrolysis, PXRD and UV-vis leaching check1
PXRD with Pawley refinement and DFT structural model1
ex situ XPS, Ni L2,3-edge NEXAFS, in situ FT-IR/PXRD, ex situ SEM1
post-photocatalysis N2 adsorption, PXRD, SEM/TEM-EDS1
Grazing-incidence wide-angle X-ray scattering (GIWAXS) and XRD comparison1
Calculated/theoretical powder XRD reference patterns1
Powder/thin-film X-ray diffraction, X'Pert PRO, Cu Kα radiation, 0.02 degree step1
SEM, TEM, EDS mapping, and XRD1
powder X-ray diffraction, Cu Kalpha1
X-ray diffraction and BJH adsorption pore-diameter analysis1
powder X-ray diffraction and Rietveld refinement after acid soaking1
powder X-ray diffraction and Rietveld refinement after sensor stability testing1
powder X-ray diffraction and Rietveld refinement1
Out-of-plane X-ray diffraction (XRD)1
P-XRD1
SEM and P-XRD after cycling1
X-ray diffraction using D8 ADVANCE, Cu Kalpha radiation1
Powder X-ray diffraction (Cu source)1
Cyclic voltammetric stability scan plus SEM/XRD checks1
paper sensor morphology/PXRD/EDS1
Powder X-ray diffraction (Bruker D8 Advance, Cu-Kalpha)1
Powder/thin-film X-ray diffraction with BRUKER AXS D8 ADVANCE, Cu Kalpha1
XRD plus UV-vis/Tauc analysis of ZnO film1
SEM and out-of-plane XRD1
Powder X-ray diffraction (Ultima IV)1
Powder X-ray diffraction using Rigaku Miniflex, Cu Kalpha radiation (lambda = 1.54 A, 40 kV, 15 mA)1
Powder X-ray diffraction and DFT-optimised crystal model1
CV cycling durability and post-test SEM/XRD1
Powder X-ray diffraction / Pawley and Rietveld refinement with Mo-Kalpha radiation; DFT-assisted structural optimisation1