Information card for entry 7705960

Structure parameters

• Formula: Al B5 Cs2 O10
• Calculated formula: Al B5 Cs2 O10
• Title of publication: Cs₂AlB₅O₁₀: a short-wavelength nonlinear optical crystal with moderate second harmonic generation response.
• Authors of publication: Baiheti, Tuohetijiang; Han, Shujuan; Jin, Wenqi; Yang, Zhihua; Pan, Shilie
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 3
• Pages of publication: 822 - 825
• a: 7.029 ± 0.004 Å
• b: 7.029 ± 0.004 Å
• c: 20.97 ± 0.03 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 897.3 ± 1.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Residual factor for all reflections: 0.0815
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.1218
• Weighted residual factors for all reflections included in the refinement: 0.1404
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No