Crystallography Open Database

Information card for entry 4126817

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Coordinates	4126817.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B15 Bi2 K7 O30 Sr
Calculated formula	B15 Bi2 K7 O30 Sr
Title of publication	Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials.
Authors of publication	Mutailipu, Miriding; Xie, Zhiqing; Su, Xin; Zhang, Min; Wang, Ying; Yang, Zhihua; Janjua, Muhammad Ramzan Saeed Ashraf; Pan, Shilie
Journal of publication	Journal of the American Chemical Society
Year of publication	2017
a	13.2512 ± 0.0019 Å
b	13.2512 ± 0.0019 Å
c	15.288 ± 0.004 Å
α	90°
β	90°
γ	120°
Cell volume	2324.8 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	155
Hermann-Mauguin space group symbol	R 3 2 :H
Hall space group symbol	R 3 2"
Residual factor for all reflections	0.0217
Residual factor for significantly intense reflections	0.0195
Weighted residual factors for significantly intense reflections	0.0437
Weighted residual factors for all reflections included in the refinement	0.0448
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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