Information card for entry 4000922

Structure parameters

• Formula: H2 O7 Se2 V
• Calculated formula: H O3.5 Se V0.5
• Title of publication: Stereo-Active Lone-Pair Control on the Ferromagnetic Behavior in VO(SeO2OH)2: A New Acentric Ferromagnetic Material
• Authors of publication: Kim, Sang-Hwan; Yeon, Jeongho; Sefat, Athena S.; Mandrus, David G.; Halasyamani, P. Shiv
• Journal of publication: Chemistry of Materials
• Year of publication: 2010
• Journal volume: 22
• Journal issue: 24
• Pages of publication: 6665
• a: 8.9181 ± 0.0003 Å
• b: 8.9181 ± 0.0003 Å
• c: 7.9708 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 633.94 ± 0.06 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 114
• Hermann-Mauguin space group symbol: P -4 21 c
• Hall space group symbol: P -4 2n
• Residual factor for all reflections: 0.0186
• Residual factor for significantly intense reflections: 0.0125
• Weighted residual factors for all reflections included in the refinement: 0.0303
• Goodness-of-fit parameter for all reflections included in the refinement: 0.905
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No