Information card for entry 4101360

Structure parameters

• Formula: Mg2.52 Sc11.18 Zn73.61
• Calculated formula: Mg2.535 Sc11.17 Zn73.612
• Title of publication: The 1/1 and 2/1 approximants in the Sc-Mg-Zn quasicrystal system: triacontahedral clusters as fundamental building blocks.
• Authors of publication: Lin, Qisheng; Corbett, John D
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Journal issue: 40
• Pages of publication: 13268 - 13273
• a: 22.412 ± 0.002 Å
• b: 22.412 ± 0.002 Å
• c: 22.412 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11257.5 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.1326
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for significantly intense reflections: 0.1201
• Weighted residual factors for all reflections included in the refinement: 0.144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No