Information card for entry 4127195

Structure parameters

• Formula: F Fe Li0.885 Na0.726 O4 P
• Calculated formula: F Fe Li0.885 Na0.726 O4 P
• Title of publication: The role of semi-labile oxygen atoms for intercalation chemistry of the metal-ion battery polyanion cathodes.
• Authors of publication: Tereshchenko, Ivan V.; Aksyonov, Dmitry A.; Drozhzhin, Oleg A.; Presniakov, Igor A.; Sobolev, Alexey V.; Zhugayevych, Andriy; Striukov, Daniil; Stevenson, Keith J.; Antipov, Evgeny; Abakumov, Artem M.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• a: 5.0137 ± 0.0004 Å
• b: 13.9038 ± 0.0011 Å
• c: 11.1839 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 779.62 ± 0.1 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.0447
• Weighted residual factors for all reflections: 0.0795
• Weighted residual factors for significantly intense reflections: 0.0795
• Goodness-of-fit parameter for all reflections: 24.52
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7121 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No