Crystallography Open Database

Information card for entry 4312727

Preview

Coordinates	4312727.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Gd6.67 Ge3.33 Si2
Calculated formula	Gd6.66667 Ge3.65467 Si1.68
Title of publication	"Nanoscale Zippers" in Gd5(SixGe1-x)4: Symmetry and Chemical Influences on the Nanoscale Zipping Action
Authors of publication	Wonyoung Choe; A. O. Pecharsky; Michael Wörle; Gordon J. Miller
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	8223 - 8229
a	7.6652 ± 0.0012 Å
b	14.809 ± 0.002 Å
c	7.7695 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	881.9 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.054
Residual factor for significantly intense reflections	0.0421
Weighted residual factors for significantly intense reflections	0.1064
Weighted residual factors for all reflections included in the refinement	0.1128
Goodness-of-fit parameter for all reflections included in the refinement	0.811
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
179166 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/27.	4312727.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4312727.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4312727.cif
5741	2011-01-06	../uploads/cif-deposit/cod/cif Adding structures of 4312727 via cif-deposit CGI script.	4312727.cif