Crystallography Open Database

Information card for entry 4001015

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Coordinates	4001015.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	O12 Rb Se2 V3
Calculated formula	O12 Rb Se2 V3
Title of publication	New Polar Oxides: Synthesis, Characterization, Calculations, and Structure−Property Relationships in RbSe2V3O12and TlSe2V3O12
Authors of publication	Chang, Hong Young; Kim, Sang-Hwan; Ok, Kang Min; Halasyamani, P. Shiv
Journal of publication	Chemistry of Materials
Year of publication	2009
Journal volume	21
Journal issue	8
Pages of publication	1654
a	7.1364 ± 0.0004 Å
b	7.1364 ± 0.0004 Å
c	11.4687 ± 0.0013 Å
α	90°
β	90°
γ	120°
Cell volume	505.83 ± 0.07 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0209
Residual factor for significantly intense reflections	0.0189
Weighted residual factors for significantly intense reflections	0.0349
Weighted residual factors for all reflections included in the refinement	0.0353
Goodness-of-fit parameter for all reflections included in the refinement	0.99
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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