Information card for entry 4338587

Structure parameters

• Formula: Co Cr2 Se4
• Calculated formula: Co0.96 Cr2 Se4
• Title of publication: High-Temperature Order-Disorder Transition in CoCr~2~Se~4~ and Trapping Co Disorder in Monoclinic CoCr~2~Se~4~: Structural Features of Cu~1-x~Co~x~Cr~2~Se~4~ Phases
• Authors of publication: Svitlyk, Volodymyr; Mozharivskyj, Yurij
• Journal of publication: Inorganic chemistry
• Year of publication: 2009
• Journal volume: 48
• Journal issue: 12
• Pages of publication: 5296 - 5302
• a: 13.025 ± 0.006 Å
• b: 3.6063 ± 0.0012 Å
• c: 6.263 ± 0.003 Å
• α: 90°
• β: 117.88 ± 0.03°
• γ: 90°
• Cell volume: 260 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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
• Residual factor for all reflections: 0.1385
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.0833
• Weighted residual factors for all reflections included in the refinement: 0.0999
• Goodness-of-fit parameter for all reflections included in the refinement: 0.847
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No