Information card for entry 1562979

Structure parameters

• Formula: F3 Na Ni
• Calculated formula: F3 Na Ni
• Title of publication: High-pressure stability relations, crystal structures, and physical properties of perovskite and post-perovskite of NaNiF3
• Authors of publication: Shirako, Y.; Shi, Y.G.; Aimi, A.; Mori, D.; Kojitani, H.; Yamaura, K.; Inaguma, Y.; Akaogi, M.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2012
• Journal volume: 191
• Pages of publication: 167 - 174
• a: 5.53607 ± 0.00004 Å
• b: 7.7056 ± 0.00006 Å
• c: 5.36741 ± 0.00004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 228.967 ± 0.003 ų
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 3
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.01688
• RFsqd: 0.01688
• Residual factor R(I) for significantly intense reflections: 0.02768
• Goodness-of-fit parameter for all reflections: 0.5353
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.51973 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No