Crystallography Open Database

Information card for entry 4337282

Preview

Coordinates	4337282.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B5 Be2 Gd O11
Calculated formula	B5 Be2 Gd O11
Title of publication	ReBe2B5O11 (Re = Y, Gd): Rare-Earth Beryllium Borates as Deep-Ultraviolet Nonlinear-Optical Materials.
Authors of publication	Yan, Xue; Luo, Siyang; Lin, Zheshuai; Yao, Jiyong; He, Ran; Yue, Yinchao; Chen, Chuangtian
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	4
Pages of publication	1952 - 1954
a	25.784 ± 0.005 Å
b	4.3454 ± 0.0009 Å
c	6.6886 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	749.4 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0241
Residual factor for significantly intense reflections	0.0222
Weighted residual factors for significantly intense reflections	0.0434
Weighted residual factors for all reflections included in the refinement	0.0441
Goodness-of-fit parameter for all reflections included in the refinement	1.067
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
179475 (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 4/33/72.	4337282.cif
106257	2014-03-15	cif/ Adding structures of 4337282 via cif-deposit CGI script.	4337282.cif