Information card for entry 2012180

Structure parameters

• Formula: Ca2 Li Nb3 O10
• Calculated formula: Ca2 Li Nb3 O10
• Title of publication: A synchrotron X-ray study of triclinic LiCa~2~Nb~3~O~10~ with perovskite-type slabs
• Authors of publication: Ishizawa, Nobuo; Yamashita, Reiko; Oishi, Shuji; Hester, James R.; Kishimoto, Shunji
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 9
• Pages of publication: 1006 - 1009
• a: 5.4809 ± 0.0003 Å
• b: 5.4804 ± 0.0003 Å
• c: 26.5533 ± 0.0016 Å
• α: 89.999 ± 0.004°
• β: 90.245 ± 0.004°
• γ: 89.999 ± 0.005°
• Cell volume: 797.59 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.169
• Goodness-of-fit parameter for all reflections included in the refinement: 0.941
• Diffraction radiation wavelength: 0.75008 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes