Crystallography Open Database

Information card for entry 4339977

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Coordinates	4339977.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Au0.987 Cd4.07
Calculated formula	Au0.986667 Cd4.06989
Title of publication	AuCd4: A Hume-Rothery Phase with VEC of 1.8 and Icosahedral and Trigonal-Prismatic Clusters as Building Blocks.
Authors of publication	Jana, Partha P.; Lidin, Sven
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	3
Pages of publication	713 - 721
a	21.3259 ± 0.0014 Å
b	21.3259 ± 0.0014 Å
c	14.1254 ± 0.0009 Å
α	90°
β	90°
γ	120°
Cell volume	5563.5 ± 0.6 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	2
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0982
Residual factor for significantly intense reflections	0.0435
Weighted residual factors for significantly intense reflections	0.0769
Weighted residual factors for all reflections included in the refinement	0.098
Goodness-of-fit parameter for significantly intense reflections	1.14
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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