Information card for entry 2218496

Structure parameters

• Chemical name: Praseodymium calcium dimolybdenum heptaoxide
• Formula: Ca0.63 Mo2 O7 Pr1.37
• Calculated formula: Ca0.63 Mo2 O7 Pr1.37
• Title of publication: The pyrochlore-type molybdate Pr~1.37~Ca~0.63~Mo~2~O~7~
• Authors of publication: Gall, P.; Gougeon, P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 6
• Pages of publication: i42
• a: 10.4329 ± 0.0003 Å
• b: 10.4329 ± 0.0003 Å
• c: 10.4329 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1135.57 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 227
• Hermann-Mauguin space group symbol: F d -3 m :2
• Hall space group symbol: -F 4vw 2vw 3
• Residual factor for all reflections: 0.0394
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0766
• Weighted residual factors for all reflections included in the refinement: 0.0859
• Goodness-of-fit parameter for all reflections included in the refinement: 1.115
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes