Crystallography Open Database

Information card for entry 4341196

Preview

Coordinates	4341196.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Cesium Thorium Arsenate
Formula	As2 Cs2 O8 Th
Calculated formula	As2 Cs2 O8 Th
Title of publication	Morphotropy and Temperature-Driven Polymorphism in A2Th(AsO4)2 (A = Li, Na, K, Rb, Cs) Series.
Authors of publication	Yu, Na; Klepov, Vladislav V.; Modolo, Giuseppe; Bosbach, Dirk; Suleimanov, Evgeny V.; Gesing, Thorsten M.; Robben, Lars; Alekseev, Evgeny V.
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	20
Pages of publication	11231 - 11241
a	7.3205 ± 0.0005 Å
b	7.3205 ± 0.0005 Å
c	18.6231 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	998.01 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	141
Hermann-Mauguin space group symbol	I 41/a m d :2
Hall space group symbol	-I 4bd 2
Residual factor for all reflections	0.0441
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.1089
Weighted residual factors for all reflections included in the refinement	0.1117
Goodness-of-fit parameter for all reflections included in the refinement	1.236
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
179514 (current)	2016-03-23	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/11.	4341196.cif
126910	2014-11-12	cif/ Updating files of 4341195, 4341196, 4341197, 4341198, 4341199 Original log message: Adding full bibliography for 4341195--4341199.cif.	4341196.cif
124511	2014-10-03	cif/ Adding structures of 4341196 via cif-deposit CGI script.	4341196.cif