Information card for entry 7701402

Structure parameters

• Formula: H O8 S2 Tb
• Calculated formula: H O8 S2 Tb
• Title of publication: Tb(HSO4)(SO4) ‒ a green emitting hydrogensulfate sulfate with second harmonic generation response
• Authors of publication: Netzsch, Philip; Bariss, Harijs; Bayarjargal, Lkhamsuren; Höppe, Henning A.
• Journal of publication: Dalton Transactions
• Year of publication: 2019
• a: 6.6503 ± 0.0005 Å
• b: 6.5941 ± 0.0005 Å
• c: 6.8024 ± 0.0005 Å
• α: 90°
• β: 104.64 ± 0.002°
• γ: 90°
• Cell volume: 288.62 ± 0.04 ų
• Cell temperature: 250 ± 2 K
• Ambient diffraction temperature: 250 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.025
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for significantly intense reflections: 0.0358
• Weighted residual factors for all reflections included in the refinement: 0.0367
• Goodness-of-fit parameter for all reflections included in the refinement: 0.926
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No