Information card for entry 1561383

Structure parameters

• Formula: Ca Ga1.14 Sn0.86
• Calculated formula: Ca Ga1.14 Sn0.86
• Title of publication: A phase width for CaGaSn. Crystal structure of mixed intermetallic Ca4Ga4+xSn4−x and SmGaxSn3−x, stability, geometry and electronic structure
• Authors of publication: Tillard, Monique
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2016
• Journal volume: 242
• Pages of publication: 63 - 70
• a: 4.4233 ± 0.0009 Å
• b: 4.4233 ± 0.0009 Å
• c: 17.601 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 298.24 ± 0.15 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 3
• Space group number: 194
• Hermann-Mauguin space group symbol: P 63/m m c
• Hall space group symbol: -P 6c 2c
• Residual factor for all reflections: 0.0673
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1042
• Weighted residual factors for all reflections included in the refinement: 0.1142
• Goodness-of-fit parameter for all reflections included in the refinement: 1.183
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No