Information card for entry 1562188

Structure parameters

• Common name: Potassium Titanium Scandium Oxide
• Chemical name: Potassium Titanium Scandium Oxide
• Formula: K1.51 O16 Sc1.51 Ti6.49
• Calculated formula: K1.512 O16 Sc1.512 Ti6.488
• Title of publication: Synthesis and crystal chemistry of microporous titanates K (Ti,M)8O16 where M=Sc‒Ni
• Authors of publication: Moetakef, Pouya; Larson, Amber M.; Hodges, Brenna C.; Zavalij, Peter; Gaskell, Karen J.; Piccoli, Philip M.; Rodriguez, Efrain E.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2014
• Journal volume: 220
• Pages of publication: 45 - 53
• a: 10.244 ± 0.002 Å
• b: 10.244 ± 0.002 Å
• c: 3.0077 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 315.63 ± 0.11 ų
• Cell temperature: 149 ± 2 K
• Ambient diffraction temperature: 149 ± 2 K
• Number of distinct elements: 4
• Space group number: 87
• Hermann-Mauguin space group symbol: I 4/m
• Hall space group symbol: -I 4
• Residual factor for all reflections: 0.022
• Residual factor for significantly intense reflections: 0.0191
• Weighted residual factors for significantly intense reflections: 0.0433
• Weighted residual factors for all reflections included in the refinement: 0.0443
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No