Crystallography Open Database

Information card for entry 4338534

Preview

Coordinates	4338534.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Au1.77 Ba Sn2.23
Calculated formula	Au1.774 Ba Sn2.226
Title of publication	Ordered BaAl4-Type Variants in the BaAuxSn4-x System: A Unified View on Their Phase Stabilities versus Valence Electron Counts.
Authors of publication	Lin, Qisheng; Miller, Gordon J.; Corbett, John D.
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	12
Pages of publication	5875 - 5877
a	4.7995 ± 0.0001 Å
b	4.7995 ± 0.0001 Å
c	11.2738 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	259.694 ± 0.01 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	129
Hermann-Mauguin space group symbol	P 4/n m m
Hall space group symbol	-P 4a 2a
Residual factor for all reflections	0.0233
Residual factor for significantly intense reflections	0.021
Weighted residual factors for significantly intense reflections	0.0443
Weighted residual factors for all reflections included in the refinement	0.045
Goodness-of-fit parameter for all reflections included in the refinement	1.17
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
179488 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/85.	4338534.cif
119089	2014-07-05	cif/ Updating files of 4338527, 4338528, 4338529, 4338530, 4338531, 4338532, 4338533, 4338534, 4338535, 4338536, 4338537 Original log message: Adding full bibliography for 4338527--4338537.cif.	4338534.cif
114644	2014-05-29	cif/ Adding structures of 4338527, 4338528, 4338529, 4338530, 4338531, 4338532, 4338533, 4338534, 4338535, 4338536, 4338537 via cif-deposit CGI script.	4338534.cif