Information card for entry 4002817

Structure parameters

• Mineral name: CuBi
• Formula: Bi Cu
• Calculated formula: Bi Cu
• Title of publication: Creating Binary Cu‒Bi Compounds via High-Pressure Synthesis: A Combined Experimental and Theoretical Study
• Authors of publication: Clarke, Samantha M.; Amsler, Maximilian; Walsh, James P. S.; Yu, Tony; Wang, Yanbin; Meng, Yue; Jacobsen, Steven D.; Wolverton, Chris; Freedman, Danna E.
• Journal of publication: Chemistry of Materials
• Year of publication: 2017
• Journal volume: 29
• Journal issue: 12
• Pages of publication: 5276
• a: 5.188995 ± 0.000016 Å
• b: 4.230802 ± 0.000012 Å
• c: 7.86657 ± 0.00002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 172.7 ± 0.0008 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 2
• Space group number: 51
• Hermann-Mauguin space group symbol: P m m a
• Hall space group symbol: -P 2a 2a
• Residual factor for all reflections: 1.107
• Goodness-of-fit parameter for all reflections: 1.15
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.414204 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No