Information card for entry 2300635

Structure parameters

• Formula: F Fe O3 Se
• Calculated formula: F Fe O3 Se
• Title of publication: On the quality of the continuous rotation electron diffraction data for accurate atomic structure determination of inorganic compounds
• Authors of publication: Wang, Yunchen; Yang, Taimin; Xu, Hongyi; Zou, Xiaodong; Wan, Wei
• Journal of publication: Journal of Applied Crystallography
• Year of publication: 2018
• Journal volume: 51
• Journal issue: 4
• a: 4.956 ± 0.001 Å
• b: 5.202 ± 0.001 Å
• c: 12.04 ± 0.002 Å
• α: 90°
• β: 97.87 ± 0.03°
• γ: 90°
• Cell volume: 307.48 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2098
• Residual factor for significantly intense reflections: 0.1887
• Weighted residual factors for significantly intense reflections: 0.4585
• Weighted residual factors for all reflections included in the refinement: 0.4706
• Goodness-of-fit parameter for all reflections included in the refinement: 1.236
• Diffraction radiation wavelength: 0.0251 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes