Information card for entry 2229370

Structure parameters

• Chemical name: aluminium(III) triniobium(V) phosphate(V)
• Formula: Al0.5 Nb1.5 O12 P3
• Calculated formula: Al0.5 Nb1.5 O12 P3
• Title of publication: Al~0.5~Nb~1.5~(PO~4~)~3~
• Authors of publication: Zhao, Dan; Liang, Peng; Su, Ling; Chang, Huan; Yan, Shi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 3
• Pages of publication: i23
• a: 8.5679 ± 0.0006 Å
• b: 8.5679 ± 0.0006 Å
• c: 21.898 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1392.14 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0275
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0637
• Weighted residual factors for all reflections included in the refinement: 0.0638
• Goodness-of-fit parameter for all reflections included in the refinement: 1.393
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes