cMOF Evidence Base
Diffraction Structure — Conductive metal-organic frameworks with wheel-shaped metallomacrocycle subunits as high-performance supercapacitor electrodes

Measurement evidence

Diffraction Structure

Conductive metal-organic frameworks with wheel-shaped metallomacrocycle subunits as high-performance supercapacitor electrodes · Yan Y., Lin X., Ge J. et al. · Chemical Engineering Journal · 2023 · 143739

2 measurement groups · 8 results

Reported values remain attached to the sample, method, conditions, extraction quality and source location that produced them.

powder X-ray diffraction (Bruker D8 ADVANCE, Cu Kalpha)

X-ray diffraction and scattering

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

Geometry
powder
Context
pristine MWM-1(Co/2Ni) with control MWM-1(Co)
Measurement source
2, 5, 9 · Sections 2.2, 3.1 and Discussion · Supplementary Fig. S9
PropertyReported valueNormalised valueUncertaintyOrigin and qualitySource
PXRD purity assignmentPXRD peaks matched SXRD fitting diagrams; high purities for MWM-1(Co/2Ni) and MWM-1(Co)——Text
Qualitative		5 · Section 3.1 · Supplementary Fig. S9

single-crystal X-ray diffraction (Bruker APEX II, Mo Kalpha); SHELXTL refinement

X-ray diffraction and scattering

MWM-1 (Co/2Ni) powder/crystals · Powder

single crystal; graphite-monochromated Mo Kalpha radiation lambda = 0.71073 A

Geometry
single crystal
Context
pristine mixed-metal framework
Measurement source
2, 4 · Sections 2.2 and 3.1 · Table S1; Fig. 1
PropertyReported valueNormalised valueUncertaintyOrigin and qualitySource
unit-cell a28.1095(10)—(10)SI Table
Exact Reported		S1-S10 · Table S1 · Table S1
unit-cell c40.1526(13)—(13)SI Table
Exact Reported		S1-S10 · Table S1 · Table S1
unit-cell volume27476(2)—(2)SI Table
Exact Reported		S1-S10 · Table S1 · Table S1
crystal formulaC112H82Co5Ni5O40S16——SI Table
Exact Reported		S1-S10 · Table S1 · Table S1
inherent framework density1.724 g cm-3——Text
Exact Reported		5 · Section 3.1 · Fig. 2
R[F2 > 2sigma(F2)]0.0366——SI Table
Exact Reported		S1-S10 · Table S1 · Table S1
space groupTrigonal, R3c——SI Table
Exact Reported		S1-S10 · Table S1 · Table S1