Crystallography Open Database

Information card for entry 8102973

Preview

Coordinates	8102973.cif

Structure parameters

Chemical name	nickel germanium sellenide
Formula	Ge Ni5 Se2
Calculated formula	Ge Ni5.448 Se2
Title of publication	Crystal structures of nickel germanium selenide, Ni~5.45~GeSe~2~, and nickel germanium telluride, Ni~5.45~GeTe~2~
Authors of publication	Deiseroth, Hans-Jörg; Spirovski, Filip; Reiner, Christof; Schlosser, Marc
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2007
Journal volume	222
Journal issue	3
Pages of publication	171 - 172
a	3.6117 ± 0.0004 Å
b	3.6117 ± 0.0004 Å
c	18.281 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	238.46 ± 0.05 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	139
Hermann-Mauguin space group symbol	I 4/m m m
Hall space group symbol	-I 4 2
Residual factor for all reflections	0.0531
Residual factor for significantly intense reflections	0.051
Weighted residual factors for significantly intense reflections	0.0714
Weighted residual factors for all reflections included in the refinement	0.0778
Goodness-of-fit parameter for all reflections included in the refinement	1.275
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
176728 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8.	8102973.cif
108388	2014-03-31	cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page.	8102973.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102973.cif
13712	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102973 via cif-deposit CGI script.	8102973.cif