Crystallography Open Database

Information card for entry 7127695

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Coordinates	7127695.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	As14 Ba Ge8
Calculated formula	As14 Ba Ge8
Title of publication	BaGe<sub>8</sub>As<sub>14</sub>: a semiconducting sodalite-type compound.
Authors of publication	Weippert, Valentin; Chau, Thanh; Witthaut, Kristian; Eisenburger, Lucien; Johrendt, Dirk
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2021
Journal volume	57
Journal issue	11
Pages of publication	1332 - 1335
a	10.3018 ± 0.0002 Å
b	10.3018 ± 0.0002 Å
c	10.3018 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	1093.3 ± 0.04 Å³
Cell temperature	143 ± 2 K
Ambient diffraction temperature	143 ± 2 K
Number of distinct elements	3
Space group number	217
Hermann-Mauguin space group symbol	I -4 3 m
Hall space group symbol	I -4 2 3
Residual factor for all reflections	0.0119
Residual factor for significantly intense reflections	0.0117
Weighted residual factors for significantly intense reflections	0.0364
Weighted residual factors for all reflections included in the refinement	0.0364
Goodness-of-fit parameter for all reflections included in the refinement	1.468
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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