Information card for entry 7042947

Structure parameters

• Formula: Ba Cu F O4 P
• Calculated formula: Ba Cu F O4 P
• Title of publication: Synthesis and magnetic properties of two isostructural fluorophosphates BaMPO4F (M = Cu, Co) with a tunnel structure
• Authors of publication: Qiu, Chaoqun; He, Zhangzhen; Cui, Meiyan; Chen, Sihuai
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 4.9167 ± 0.0002 Å
• b: 8.8988 ± 0.0006 Å
• c: 9.4929 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 415.34 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0255
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0645
• Weighted residual factors for all reflections included in the refinement: 0.0646
• Goodness-of-fit parameter for all reflections included in the refinement: 1.184
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No