Information card for entry 4304448

Structure parameters

• Common name: Strontium Barium Bismuthide
• Formula: Ba0.86 Bi3 Sr1.14
• Calculated formula: Ba0.86 Bi3 Sr1.14
• 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: 15.881 ± 0.003 Å
• b: 6.8883 ± 0.0014 Å
• c: 6.704 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 733.4 ± 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: 0.0413
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0799
• Weighted residual factors for all reflections included in the refinement: 0.0815
• Goodness-of-fit parameter for all reflections included in the refinement: 0.931
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No