Information card for entry 2008100

Structure parameters

• Formula: Ba Nb3.47 O6 Ti0.53
• Calculated formula: Ba Nb3.466 O6 Ti0.534
• Title of publication: BaNb~4-<i>x~</i>Ti~<i>x~</i>O~6~ (<i>x</i> = 0.53)
• Authors of publication: Svensson, Gunnar; Eriksson, Lars
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 1
• Pages of publication: 17 - 19
• a: 4.1662 ± 0.0003 Å
• b: 4.1662 ± 0.0003 Å
• c: 8.2085 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 142.477 ± 0.019 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 123
• Hermann-Mauguin space group symbol: P 4/m m m
• Hall space group symbol: -P 4 2
• Residual factor for all reflections: 0.021
• Residual factor for significantly intense reflections: 0.016
• Weighted residual factors for all reflections: 0.028
• Weighted residual factors for all reflections included in the refinement: 0.027
• Goodness-of-fit parameter for all reflections: 1.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.185
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes