Information card for entry 2234031

Structure parameters

• Chemical name: Hafnium titanium pentatelluride
• Formula: Hf0.78 Te5 Ti0.22
• Calculated formula: Hf0.781 Te5 Ti0.219
• Title of publication: Ti insertion in the <i>M</i>Te~5~ (<i>M</i> = Zr, Hf) structure type: Hf~0.78~Ti~0.22~Te~5~
• Authors of publication: Yu, Jaemin; Yun, Hoseop
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: i19
• a: 3.9595 ± 0.0003 Å
• b: 14.435 ± 0.0013 Å
• c: 13.7062 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 783.38 ± 0.11 ų
• Cell temperature: 290 ± 1 K
• Ambient diffraction temperature: 290 ± 1 K
• Number of distinct elements: 3
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0303
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for all reflections included in the refinement: 0.0682
• Goodness-of-fit parameter for all reflections included in the refinement: 1.157
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes