Information card for entry 2312719

Structure parameters

• Formula: Cu0 H O13 P3 Pb5
• Calculated formula: H O13 P3 Pb5
• Title of publication: Polymorphism of Pb₅(PO₄)₃OH_δ within the LK-99 mixture.
• Authors of publication: Xu, Mingyu; Wang, Haozhe; Vojvodin, Cameron; Yarava, Jayasubba Reddy; Wang, Tuo; Xie, Weiwei
• Journal of publication: Acta crystallographica Section B, Structural science, crystal engineering and materials
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 6
• Pages of publication: 746 - 750
• a: 13.5137 ± 0.0004 Å
• b: 10.2904 ± 0.0004 Å
• c: 9.3838 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1304.92 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0811
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.0681
• Weighted residual factors for all reflections included in the refinement: 0.0758
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No