Choi J.Y., Check B., Fang X. et al. · Journal of the American Chemical Society · 2024
Open a family to keep every result attached to its sample, method and conditions.
Paraphrased for this database from the authors’ stated interpretations — never quoted verbatim — and kept separate from reported measurements.
EFB-MOF is the best photocatalyst in this MOF series for visible-light H2O2 production in O2-saturated water.
Caveat: Performance comparison to external catalysts depends on differing literature conditions; only within-paper MOF series comparison is direct.
main p.1, article p.11319 · Abstract · Figure 4a · Linked to 4 structured results
EFB-MOF is recyclable and structurally stable under the reported photocatalysis cycling conditions.
Caveat: Activity is reported to become slightly sluggish over five cycles; long-term durability beyond five cycles is not shown.
main p.6, article p.11324 · Photocatalytic H2O2 Production and Mechanistic Insights · Figure S23 · Linked to 1 structured result
The Cu3(C6O6)2 optical control is included as a conductive-MOF material, but its synthesis recipe is not first-hand in the supplied article or SI.
Caveat: The article cites a reported method rather than reproducing the recipe; no external reference was fetched.
main p.3, article p.11321 · Characterizations of Optical and Electronic Properties · Figure 3a
DPT-MOF is a newly reported semiconductive MOF produced by pillaring the conductive Cu3(C6O6)2 framework with DPT.
Caveat: No single-crystal structure is reported; phase assignment relies on PXRD/Pawley matching and supporting characterisation.
main p.2, article p.11320 · Introduction · Figure 1 · Linked to 5 structured results
PA and EFB click functionalisation increases the optical band gap and shifts band positions relative to DPT-MOF.
Caveat: Conduction-band energies are calculated from reported UPS EVB and optical band gaps; figure labels are not tabulated.
main p.3, article p.11321 · Characterizations of Optical and Electronic Properties · Figure 3 · Linked to 9 structured results
Postsynthetic click-type reactions with PA and EFB successfully functionalise the DPT-MOF tetrazine units while retaining framework crystallinity.
Caveat: Functionalisation extent is inferred from spectroscopy and digestion ratios; exact empirical formulas are not reported.
main p.2, article p.11320 · Synthesis and Characterization · Figure 1a and Figures S6-S10 · Linked to 7 structured results
The fluorine-containing EFB functionality promotes charge separation by trapping electrons, giving longer PL lifetime, lower exciton binding energy, higher photocurrent, and improved H2O2 production.
Caveat: Photocurrent values are figure estimates and EIS is qualitative; mechanistic charge localisation is computational support.
main p.5, article p.11323 · Photocatalytic H2O2 Production and Mechanistic Insights · Figures 4 and 5 · Linked to 6 structured results
Time-dependent FTIR supports both OH and superoxide intermediates, and the authors infer an indirect two-electron ORR pathway for H2O2 formation.
Caveat: Intermediates are assigned from FTIR bands and scavenger controls; kinetic pathway is inferred rather than directly measured by isotope or operando quantitative spectroscopy.
main p.6, article p.11324 · Photocatalytic H2O2 Production and Mechanistic Insights · Figure 4f and Figure S21 · Linked to 3 structured results
All three MOFs show semiconductive transport behaviour because their pressed-pellet conductivity increases with temperature and Arrhenius activation energies are positive.
Caveat: Conductivity is low and measured on pressed pellets; no single-crystal or thin-film anisotropic transport is reported.
main p.5, article p.11323 · Characterizations of Optical and Electronic Properties · Figure 3d · Linked to 7 structured results
Names and aliases are kept exactly within the paper’s own identity model.
| Material | Composition | Structure context | Source |
|---|---|---|---|
| Cu3(C6O6)2 controlBrowse family: Cu₃(C₆O₆)₂ (Cu–THQ / Cu–HHB) | Cu3(C6O6)2Copper nodes in a 2D electrically conductive framework. · C6O6 layer linker derived from tetrahydroxybenzoquinone/hexahydroxybenzene chemistry. | 2D · PristinePreviously reported 2D electrically conductive MOF used as an optical control. | main p.3, article p.11321 · Characterizations of Optical and Electronic Properties · Figure 3a |
| DPT-MOF | DPT-pillared Cu3(C6O6)2 framework; exact empirical formula not explicitly reportedCopper nodes in Cu3(C6O6)2 layers; Cu2+ and Cu+/0 components observed before click reaction. · Tetrahydroxy-1,4-benzoquinone-derived hexahydroxybenzene/HHB layer linker and 3,6-di(4-pyridyl)-1,2,4,5-tetrazine (DPT) pillar. | 3D · PristineDPT pillar introduced into the 2D electrically conductive Cu3(C6O6)2 framework, forming a pillared semiconductive MOF with interlayer and hexagonal pores. | main p.2, article p.11320 · Introduction; Synthesis and Characterization · Figure 1a |
| EFB-MOF | 1-ethynyl-4-fluorobenzene-clicked DPT-MOF; exact empirical formula not explicitly reportedCopper nodes in the DPT-MOF-derived framework. · HHB layer linker, DPT-derived pillar after click reaction with 1-ethynyl-4-fluorobenzene (EFB). | 3D · PristineFluorophenyl-functionalised DPT-MOF retaining the simulated framework structure and showing 14.4 Angstrom interlayer and 6.6 Angstrom pore distances by HRTEM. | main p.3, article p.11321 · Synthesis and Characterization · Figure 2 |
| PA-MOF | Phenylacetylene-clicked DPT-MOF; exact empirical formula not explicitly reportedCopper nodes in the DPT-MOF-derived framework. · HHB layer linker, DPT-derived pillar after click reaction with phenylacetylene (PA). | 3D · PristinePA-clicked DPT-MOF retaining the simulated framework structure with phenyl groups residing toward the honeycomb pore. | main p.2, article p.11320 · Synthesis and Characterization · Figure 1a |
Sample form, processing state and composition status define the context for measurements.
| Sample | Form and role | Processing and geometry | Source |
|---|---|---|---|
| Cu3(C6O6)2 control powderresearch_0604__mat__cu3_c6o6_2_control | Powder · Pristine Control · Pristine Framework | Control material synthesised by a previously reported method; first-hand recipe not given. | main p.3, article p.11321 · Characterizations of Optical and Electronic Properties · Figure 3a |
| DPT-MOF/PTFE working electroderesearch_0604__mat__dpt_mof | Electrode · Pristine Control · Composite | Ink of 80 wt% MOF powder and 20 wt% PTFE binder dispersed in ethanol, drop-cast and dried at 65 C for 30 min.ITO glass for photocurrent; Pt disc for OCVD; three-electrode cell used for electrochemical measurements. | SI p.S3 · Photoelectrochemical and Electrochemical Measurements |
| DPT-MOF computational modelresearch_0604__mat__dpt_mof | Model · Model System · Model | DFT/TD-DFT model system. | SI p.S3 · Theoretical Calculations · Figure S24 |
| DPT-MOF pressed pelletresearch_0604__mat__dpt_mof | Pellet · Pristine Control · Pristine Framework | Approximately 5 mg material pressed under 1.5 tons for four-point probe conductivity.5 mm diameter circular die; thickness not reported | SI p.S2 · Materials and Instrumentations |
| DPT-MOF powderresearch_0604__mat__dpt_mof | Powder · Pristine Control · Pristine Framework | Isolated powder after one-pot hydrothermal synthesis, washing, and vacuum drying. | main p.7, article p.11325 · Experimental Section |
| EFB-MOF/PTFE working electroderesearch_0604__mat__efb_mof | Electrode · Target Sample · Composite | Ink of 80 wt% MOF powder and 20 wt% PTFE binder dispersed in ethanol, drop-cast and dried at 65 C for 30 min.ITO glass for photocurrent; Pt disc for OCVD; three-electrode cell used for electrochemical measurements. | SI p.S3 · Photoelectrochemical and Electrochemical Measurements |
| EFB-MOF computational modelresearch_0604__mat__efb_mof | Model · Model System · Model | DFT/TD-DFT model system. | main p.6, article p.11324 · Photocatalytic H2O2 Production and Mechanistic Insights · Figure 5a |
| EFB-MOF pressed pelletresearch_0604__mat__efb_mof | Pellet · Target Sample · Pristine Framework | Approximately 5 mg material pressed under 1.5 tons for four-point probe conductivity.5 mm diameter circular die; thickness not reported | SI p.S2 · Materials and Instrumentations |
| EFB-MOF powderresearch_0604__mat__efb_mof | Powder · Target Sample · Pristine Framework | Postsynthetically clicked DPT-MOF with 1-ethynyl-4-fluorobenzene, washed and vacuum dried. | main p.7, article p.11325 · Experimental Section |
| PA-MOF/PTFE working electroderesearch_0604__mat__pa_mof | Electrode · Target Sample · Composite | Ink of 80 wt% MOF powder and 20 wt% PTFE binder dispersed in ethanol, drop-cast and dried at 65 C for 30 min.ITO glass for photocurrent; Pt disc for OCVD; three-electrode cell used for electrochemical measurements. | SI p.S3 · Photoelectrochemical and Electrochemical Measurements |
| PA-MOF computational modelresearch_0604__mat__pa_mof | Model · Model System · Model | DFT/TD-DFT model system. | SI p.S19 · Computational simulation of electron and hole distribution · Figure S24 |
| PA-MOF pressed pelletresearch_0604__mat__pa_mof | Pellet · Target Sample · Pristine Framework | Approximately 5 mg material pressed under 1.5 tons for four-point probe conductivity.5 mm diameter circular die; thickness not reported | SI p.S2 · Materials and Instrumentations |
| PA-MOF powderresearch_0604__mat__pa_mof | Powder · Target Sample · Pristine Framework | Postsynthetically clicked DPT-MOF with phenylacetylene, washed and vacuum dried. | main p.7, article p.11325 · Experimental Section |