Crystallography Open Database

Information card for entry 1570710

Preview

Coordinates	1570710.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Se0.72 Te1.28 V1.13
Calculated formula	Se0.72 Te1.28 V1.128
Title of publication	Exploring the Structure and Properties of VwSeyTe2−y Mixed Crystals in the VTe2–VSe2 System
Authors of publication	Kurig, Sophia; Ketter, Fabian; Frommelius, Anne; Hakala, B. Viliam; van Leusen, Jan; Friese, Karen; Dronskowski, Richard
Journal of publication	Inorganics
Year of publication	2023
Journal volume	11
Journal issue	12
Pages of publication	481
a	3.6259 ± 0.0014 Å
b	3.6259 ± 0.0014 Å
c	6.29 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	71.62 ± 0.05 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	164
Hermann-Mauguin space group symbol	P -3 m 1
Hall space group symbol	-P 3 2"
Residual factor for all reflections	0.0222
Residual factor for significantly intense reflections	0.0204
Weighted residual factors for significantly intense reflections	0.0482
Weighted residual factors for all reflections included in the refinement	0.0491
Goodness-of-fit parameter for all reflections included in the refinement	1.208
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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