Information card for entry 4518631

Structure parameters

• Formula: Br0.67 Cs I Mn0.33
• Calculated formula: Br0.666667 Cs I Mn0.333333
• Title of publication: Light-Emitting Diodes with Manganese Halide Tetrahedron Embedded in Anti-Perovskites
• Authors of publication: Yan, Siyu; Tang, Kaixin; Lin, Yuejian; Ren, Yuanhang; Tian, Wanli; Chen, Hua; Lin, Tingting; Qiu, Longzhen; Pan, Xiaoyong; Wang, Weizhi
• Journal of publication: ACS Energy Letters
• Year of publication: 2021
• Pages of publication: 1901 - 1911
• a: 10.0942 ± 0.0005 Å
• b: 10.0942 ± 0.0005 Å
• c: 15.88 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1618.06 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 140
• Hermann-Mauguin space group symbol: I 4/m c m
• Hall space group symbol: -I 4 2c
• Residual factor for all reflections: 0.0251
• Residual factor for significantly intense reflections: 0.0227
• Weighted residual factors for significantly intense reflections: 0.0511
• Weighted residual factors for all reflections included in the refinement: 0.052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No