Information card for entry 4329699

Structure parameters

• Formula: Ca2.196 Mn Sb11 Yb11.804
• Calculated formula: Ca2.196 Mn Sb11 Yb11.804
• Title of publication: Enhanced High-Temperature Thermoelectric Performance of Yb14-xCaxMnSb11
• Authors of publication: Catherine A. Uvarov; Francisco Ortega-Alvarez; Susan M. Kauzlarich
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 7617 - 7624
• a: 16.5885 ± 0.0013 Å
• b: 16.5885 ± 0.0013 Å
• c: 21.976 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6047.3 ± 0.8 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 4
• Space group number: 142
• Hermann-Mauguin space group symbol: I 41/a c d :2
• Hall space group symbol: -I 4bd 2c
• Residual factor for all reflections: 0.0304
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0612
• Weighted residual factors for all reflections included in the refinement: 0.0635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.209
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No