Information card for entry 1562898

Structure parameters

• Formula: Ba3 Hg10 Zn
• Calculated formula: Ba3 Hg10.02 Zn0.98
• Title of publication: The new barium zinc mercurides Ba3ZnHg10 and BaZn0.6Hg3.4 ‒ Synthesis, crystal and electronic structure
• Authors of publication: Schwarz, Michael; Wendorff, Marco; Röhr, Caroline
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2012
• Journal volume: 196
• Pages of publication: 416 - 424
• a: 7.012 ± 0.003 Å
• b: 17.069 ± 0.008 Å
• c: 6.273 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 750.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 59
• Hermann-Mauguin space group symbol: P m m n :2
• Hall space group symbol: -P 2ab 2a
• Residual factor for all reflections: 0.1574
• Residual factor for significantly intense reflections: 0.0657
• Weighted residual factors for significantly intense reflections: 0.1353
• Weighted residual factors for all reflections included in the refinement: 0.1645
• Goodness-of-fit parameter for all reflections included in the refinement: 0.863
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No