Crystallography Open Database

Information card for entry 4001002

Preview

Coordinates	4001002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Bi0.75 O12 Rh4.92 Sc2.18
Calculated formula	Bi0.748 O12 Rh4.926 Sc2.176
Title of publication	AA′2Rh6O12: A New Family of Rhodium Oxides Exhibiting High Thermopower Coupled with High Electrical Conductivity
Authors of publication	Mizoguchi, Hiroshi; Zakharov, L. N.; Marshall, W. J.; Sleight, A. W.; Subramanian, M. A.
Journal of publication	Chemistry of Materials
Year of publication	2009
Journal volume	21
Journal issue	6
Pages of publication	994
a	9.202 ± 0.003 Å
b	9.202 ± 0.003 Å
c	2.987 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	219.04 ± 0.18 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0212
Residual factor for significantly intense reflections	0.0203
Weighted residual factors for significantly intense reflections	0.0527
Weighted residual factors for all reflections included in the refinement	0.054
Goodness-of-fit parameter for all reflections included in the refinement	1.282
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178377 (current)	2016-03-21	cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00.	4001002.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4001002.cif
38872	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 4001001, 4001002, 4001003, 4001004 via cif-deposit CGI script.	4001002.cif