Information card for entry 2300576

Structure parameters

• Formula: Mo4 O23.12 Sr11
• Calculated formula: Mo4 O23.12 Sr11
• Title of publication: High-temperature dynamic octahedral tilting in the ionic conductor Sr~11~Mo~4~O~23~
• Authors of publication: López, Carlos A.; Pedregosa, José C.; Fernández-Díaz, María T.; Alonso, José A.
• Journal of publication: Journal of Applied Crystallography
• Year of publication: 2016
• Journal volume: 49
• Journal issue: 1
• Pages of publication: 78 - 84
• a: 11.6416 ± 0.0004 Å
• b: 11.6416 ± 0.0004 Å
• c: 16.4524 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2229.74 ± 0.16 ų
• Cell temperature: 473 K
• Ambient diffraction temperature: 473 K
• Number of distinct elements: 3
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor R(I) for significantly intense reflections: 8.5682
• Goodness-of-fit parameter for all reflections: 3.5825
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.594 Å
• Diffraction radiation type: ConstantWavelengthNeutronDiffraction
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes