Information card for entry 4316138

Structure parameters

• Formula: O14 Tl3 V5
• Calculated formula: O14 Tl3 V5
• Title of publication: A3V5O14 (A = K+, Rb+, or Tl+), New Polar Oxides with a Tetragonal Tungsten Bronze Related Structural Topology: Synthesis, Structure, and Functional Properties
• Authors of publication: Jeongho Yeon; Sang-Hwan Kim; P. Shiv Halasyamani
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 6986 - 6993
• a: 8.7397 ± 0.0008 Å
• b: 8.7397 ± 0.0008 Å
• c: 5.0846 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 336.34 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 157
• Hermann-Mauguin space group symbol: P 3 1 m
• Hall space group symbol: P 3 -2
• Residual factor for all reflections: 0.0159
• Residual factor for significantly intense reflections: 0.0156
• Weighted residual factors for significantly intense reflections: 0.0309
• Weighted residual factors for all reflections included in the refinement: 0.031
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No