Crystallography Open Database

Information card for entry 7709596

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Coordinates	7709596.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ga8 Na4 S14
Calculated formula	Ga8 Na4 S14
Title of publication	Na4Ga8S14: A Ga-riched wide band gap ternary alkali-metal sulfide with unique [Ga12S42] 12-menbered rings
Authors of publication	Luo, Ling; Wang, Linan; Bai, Chen; Zhou, Jiazheng; Wei, Lai; Su, Xin
Journal of publication	Dalton Transactions
Year of publication	2022
a	13.526 ± 0.0004 Å
b	11.4979 ± 0.0003 Å
c	29.9592 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	4659.3 ± 0.2 Å³
Cell temperature	302 K
Ambient diffraction temperature	302 K
Number of distinct elements	3
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0404
Residual factor for significantly intense reflections	0.0297
Weighted residual factors for significantly intense reflections	0.0522
Weighted residual factors for all reflections included in the refinement	0.0556
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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