Information card for entry 2104459

Structure parameters

• Formula: Ba F4 Zn
• Calculated formula: Ba F4 Zn
• Title of publication: Ternary fluorides Ba<i>M</i>F~4~ (<i>M</i> = Zn, Mg and Mn) at low temperatures
• Authors of publication: Posse, Jose Maria; Grzechnik, Andrzej; Friese, Karen
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: 576 - 586
• a: 4.19029 ± 0.00002 Å
• b: 14.51842 ± 0.00007 Å
• c: 5.83613 ± 0.00003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 355.049 ± 0.003 ų
• Cell temperature: 50 K
• Ambient diffraction temperature: 50 K
• Number of distinct elements: 3
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for all reflections: 0.0203
• Residual factor for significantly intense reflections: 0.0194
• Weighted residual factors for significantly intense reflections: 0.0267
• Weighted residual factors for all reflections included in the refinement: 0.0268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes