Information card for entry 2312152

Structure parameters

• Formula: Y Zn5.217
• Calculated formula: Y Zn5.21733
• Title of publication: As predicted and more: modulated channel occupation in YZn_5+x.
• Authors of publication: Fredrickson, Rie T.; Fredrickson, Daniel C.
• Journal of publication: Acta crystallographica Section B, Structural science, crystal engineering and materials
• Year of publication: 2023
• Journal volume: 79
• Journal issue: 4
• a: 8.8811 ± 0.0001 Å
• b: 8.8811 ± 0.0001 Å
• c: 9.2057 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 628.812 ± 0.012 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 2
• Space group number: 163
• Hermann-Mauguin space group symbol: P -3 1 c
• Hall space group symbol: -P 3 2c
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0788
• Weighted residual factors for all reflections included in the refinement: 0.0876
• Goodness-of-fit parameter for significantly intense reflections: 1.94
• Goodness-of-fit parameter for all reflections included in the refinement: 1.53
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes