Crystallography Open Database

Information card for entry 4513481

Preview

Coordinates	4513481.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cs2 O12 Te W3
Calculated formula	Cs2 O12 Te W3
Title of publication	Top-Seeded Solution Growth, Structure, Morphology, and Functional Properties of a New Polar Crystal — Cs2TeW3O12
Authors of publication	Zhao, Peng; Cong, Hengjiang; Tian, Xiangxin; Sun, Youxuan; Zhang, Chengqian; Xia, Shengqing; Gao, Zeliang; Tao, Xutang
Journal of publication	Crystal Growth & Design
Year of publication	2015
Journal volume	15
Journal issue	9
Pages of publication	4484
a	7.3279 ± 0.0003 Å
b	7.3279 ± 0.0003 Å
c	12.4075 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	577 ± 0.04 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	173
Hermann-Mauguin space group symbol	P 63
Hall space group symbol	P 6c
Residual factor for all reflections	0.0129
Residual factor for significantly intense reflections	0.0124
Weighted residual factors for significantly intense reflections	0.0247
Weighted residual factors for all reflections included in the refinement	0.0248
Goodness-of-fit parameter for all reflections included in the refinement	1.178
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
154592 (current)	2015-09-06	cif/ Updating files of 4513481 Original log message: Adding full bibliography for 4513481.cif.	4513481.cif
152704	2015-08-04	cif/ Adding structures of 4513481 via cif-deposit CGI script.	4513481.cif