Crystallography Open Database

Information card for entry 4304962

Preview

Coordinates	4304962.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Au3 Ca Ga
Calculated formula	Au3 Ca Ga
Title of publication	Interpenetrating Networks of Three-Dimensional Penrose Tiles in CaAu3Ga, the Structurally Simplest Cubic Approximant of an Icosahedral Quasicrystal
Authors of publication	Qisheng Lin; John D. Corbett
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	3462 - 3464
a	9.0882 ± 0.0007 Å
b	9.0882 ± 0.0007 Å
c	9.0882 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	750.64 ± 0.1 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	3
Space group number	205
Hermann-Mauguin space group symbol	P a -3
Hall space group symbol	-P 2ac 2ab 3
Residual factor for all reflections	0.0294
Residual factor for significantly intense reflections	0.0284
Weighted residual factors for significantly intense reflections	0.0628
Weighted residual factors for all reflections included in the refinement	0.0634
Goodness-of-fit parameter for all reflections included in the refinement	1.182
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
179087 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/49.	4304962.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4304962.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4304962.cif
1163	2010-05-11	cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition.	4304962.cif