Crystallography Open Database

Information card for entry 4115865

Preview

Coordinates	4115865.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cu0.34 Sm Te2
Calculated formula	Cu0.338 Sm Te2
Title of publication	Syntheses, Structures, Physical Properties, and Theoretical Study of LaCu0.40Te2, NdCu0.37Te2, SmCu0.34Te2, GdCu0.33Te2, and DyCu0.32Te2
Authors of publication	Fu Qiang Huang; Paul Brazis; Carl R. Kannewurf; James A. Ibers
Journal of publication	Journal of the American Chemical Society
Year of publication	2000
Journal volume	122
Pages of publication	80 - 86
a	7.6003 ± 0.001 Å
b	8.3085 ± 0.0011 Å
c	6.1412 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	387.8 ± 0.09 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	3
Space group number	57
Hermann-Mauguin space group symbol	P b c m
Hall space group symbol	-P 2c 2b
Residual factor for all reflections	0.0258
Residual factor for significantly intense reflections	0.0253
Weighted residual factors for significantly intense reflections	0.0684
Weighted residual factors for all reflections included in the refinement	0.0687
Goodness-of-fit parameter for all reflections included in the refinement	1.341
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
178929 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/58.	4115865.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4115865.cif
70417	2012-12-24	cif/ Adding structures of 4115865 via cif-deposit CGI script.	4115865.cif