Information card for entry 1563035

Structure parameters

• Formula: Ag Cs Ga2 Se4
• Calculated formula: Ag Cs Ga2 Se4
• Title of publication: Synthesis, structure, and electronic structure of CsAgGa2Se4
• Authors of publication: Mei, Dajiang; Yin, Wenlong; Feng, Kai; Bai, Lei; Lin, Zheshuai; Yao, Jiyong; Wu, Yicheng
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2012
• Journal volume: 186
• Pages of publication: 54 - 57
• a: 11.225 ± 0.002 Å
• b: 7.9443 ± 0.0016 Å
• c: 21.303 ± 0.004 Å
• α: 90°
• β: 103.1 ± 0.03°
• γ: 90°
• Cell volume: 1850.3 ± 0.6 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0687
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1188
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No