Information card for entry 4313611

Structure parameters

• Common name: Titanium arsenic telluride
• Formula: As Te Ti
• Calculated formula: As Te Ti
• Title of publication: Synthesis, Structure, Electrical Properties, and Band Structure Calculations of TiAsTe
• Authors of publication: Fu Qiang Huang; Christine Flaschenriem; Paul Brazis; Carl R. Kannewurf; James A Ibers
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 3194 - 3198
• a: 3.573 ± 0.0008 Å
• b: 5.2491 ± 0.0012 Å
• c: 12.794 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 239.95 ± 0.1 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 3
• Space group number: 71
• Hermann-Mauguin space group symbol: I m m m
• Hall space group symbol: -I 2 2
• Residual factor for all reflections: 0.0218
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for significantly intense reflections: 0.0604
• Weighted residual factors for all reflections included in the refinement: 0.0605
• Goodness-of-fit parameter for all reflections included in the refinement: 1.506
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No