Information card for entry 1563781

Structure parameters

• Formula: Cr Si2
• Calculated formula: Cr Si2
• Title of publication: Anharmonicity and Effect of the Nanostructuring on the Lattice Dynamics of CrSi2
• Authors of publication: Moll, A.; Viennois, R.; Boehm, M.; Koza, M. M.; Sidis, Y.; Rouquette, J.; Laborde, S.; Debray, J.; Menaert, B.; Castellan, J.-P.; Candolfi, C.; Lenoir, B.; Hermet, P.; Beaudhuin, M.
• Journal of publication: The Journal of Physical Chemistry C
• Year of publication: 2021
• a: 4.4289 ± 0.0002 Å
• b: 4.4289 ± 0.0002 Å
• c: 6.3663 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 108.146 ± 0.009 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 2
• Space group number: 181
• Hermann-Mauguin space group symbol: P 64 2 2
• Hall space group symbol: P 64 2 (0 0 2)
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1091
• Weighted residual factors for all reflections included in the refinement: 0.1097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.395
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No