Crystallography Open Database

Information card for entry 4319176

4319175 << 4319176 >> 4319177

Preview

Coordinates	4319176.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Al51.29 Li52 Zn56.71
Calculated formula	Al51.36 Li52 Zn56.712
Title of publication	Experimental and Theoretical Studies of Elemental Site Preferences in Quasicrystalline Approximants (R-Phases) within the Li-Mg-Zn-Al System
Authors of publication	Chi-Shen Lee; Gordon J. Miller
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	338 - 345
a	13.9324 ± 0.0014 Å
b	13.9324 ± 0.0014 Å
c	13.9324 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	2704.4 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	204
Hermann-Mauguin space group symbol	I m -3
Hall space group symbol	-I 2 2 3
Residual factor for all reflections	0.0262
Residual factor for significantly intense reflections	0.0176
Weighted residual factors for significantly intense reflections	0.0306
Weighted residual factors for all reflections included in the refinement	0.0314
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
179271 (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 4/31/91.	4319176.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4319176.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4319176.cif
15908	2011-03-19	../uploads/cif-deposit/cod/cif Adding structures of 4319176 via cif-deposit CGI script.	4319176.cif