Information card for entry 4304449

Structure parameters

• Common name: Strontium Barium Bismuthide
• Formula: Ba0.45 Bi3 Sr1.55
• Calculated formula: Ba0.451 Bi3 Sr1.549
• Title of publication: Cation Substitution Effects in the System Sr2-xBaxBi3 (0 <= x <= 1.3): Structural Distortions Induced by Chemical Pressure
• Authors of publication: Sung-Jin Kim; Simeon Ponou; Thomas F. Fässler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 3594 - 3602
• a: 15.745 ± 0.003 Å
• b: 6.8294 ± 0.0014 Å
• c: 6.6469 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 714.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0782
• Goodness-of-fit parameter for all reflections included in the refinement: 1.224
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No