Diffraction Structure — Nanorods of a novel highly conductive 2D metal-organic framework based on perthiolated coronene for thermoelectric conversion

Measurement evidence

Diffraction Structure

Nanorods of a novel highly conductive 2D metal-organic framework based on perthiolated coronene for thermoelectric conversion · Chen Z., Cui Y., Jin Y. et al. · Journal of Materials Chemistry C · 2020 · 8199-8205

1 measurement group · 9 results

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

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

X-ray diffraction and scattering

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.

Geometry: powder
Context: pristine Ni-PTC MOF powder
Measurement source: 3 · Synthesis and structural characterizations · Fig. 2b; Fig. S3; Table S1

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
PXRD stacking assignment	Experimental PXRD matches simulated ABC stacking.	—	—	Text Qualitative	3 · Synthesis and structural characterizations · Fig. 2b; Fig. S3
PXRD (001) peak position	2theta = 25.7 deg	—	—	Text Rounded Reported	3 · Synthesis and structural characterizations · Fig. 2b
Experimental hexagonal lattice a	a = b = 13.48 A from PXRD indexing	—	—	Text Rounded Reported	3 · Synthesis and structural characterizations · Fig. 2
PXRD (100) peak position	2theta = 7.56 deg	—	—	Text Rounded Reported	3 · Synthesis and structural characterizations · Fig. 2b
PXRD (200) peak position	2theta = 14.75 deg	—	—	Text Rounded Reported	3 · Synthesis and structural characterizations · Fig. 2b
PXRD (300) peak position	2theta = 22.4 deg	—	—	Text Rounded Reported	3 · Synthesis and structural characterizations · Fig. 2b
Simulated ABC stacking a parameter	ABC a = 23.5042 A	—	—	SI Table Exact Reported	5 · Supplementary Figures · Table S1
Simulated ABC stacking b parameter	ABC b = 13.5701 A	—	—	SI Table Exact Reported	5 · Supplementary Figures · Table S1
Simulated ABC stacking c parameter	ABC c = 10.3200 A	—	—	SI Table Exact Reported	5 · Supplementary Figures · Table S1