Crystallography Open Database

Information card for entry 1561480

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Coordinates	1561480.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	lithium tribismuth pentasulfide
Formula	Bi3 Li S5
Calculated formula	Bi3 Li S5
Title of publication	LiBi3S5—A lithium bismuth sulfide with strong cation disorder
Authors of publication	Nakhal, Suliman; Wiedemann, Dennis; Stanje, Bernhard; Dolotko, Oleksandr; Wilkening, Martin; Lerch, Martin
Journal of publication	Journal of Solid State Chemistry
Year of publication	2016
Journal volume	238
Pages of publication	60 - 67
a	13.1079 ± 0.0002 Å
b	4.0007 ± 0.00007 Å
c	16.5085 ± 0.0003 Å
α	90°
β	94.0723 ± 0.0012°
γ	90°
Cell volume	863.53 ± 0.03 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	3
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Weighted residual factors for all reflections	0.0216
Residual factor R(I) for significantly intense reflections	0.0367
Goodness-of-fit parameter for all reflections	1.52
Method of determination	powder diffraction
Diffraction radiation probe	neutron
Diffraction radiation wavelength	1.54831 Å
Diffraction radiation type	neutron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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