Crystallography Open Database

Information card for entry 1520321

1520320 << 1520321 >> 1520322

Preview

Coordinates	1520321.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B Ga O3
Calculated formula	B Ga O3
Title of publication	Flux Growth and Crystal Structure Refinement of Calcite Type Borate GaBO3
Authors of publication	Wang, Shichao; Ye, Ning; Poeppelmeier, Kenneth
Journal of publication	Crystals
Year of publication	2015
Journal volume	5
Journal issue	2
Pages of publication	252
a	4.5659 ± 0.0001 Å
b	4.5659 ± 0.0001 Å
c	14.1764 ± 0.0004 Å
α	90°
β	90°
γ	120°
Cell volume	255.947 ± 0.011 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	3
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.0155
Residual factor for significantly intense reflections	0.0153
Weighted residual factors for significantly intense reflections	0.0432
Weighted residual factors for all reflections included in the refinement	0.0433
Goodness-of-fit parameter for all reflections included in the refinement	1.172
Diffraction radiation probe	x-ray
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	1520321.cif
138314	2015-06-05	cif/ Adding structures of 1520321 via cif-deposit CGI script.	1520321.cif