Information card for entry 7055713

Structure parameters

• Common name: Gd3S3BO3
• Formula: B Gd3 O3 S3
• Calculated formula: B Gd3 O3 S3
• Title of publication: Crystal and electronic structures, and optical and magnetic properties of novel rare-earth sulfide borates RE3S3BO3(RE = Sm, Gd)
• Authors of publication: Chi, Yang; Guo, Sheng-Ping; Kong, Hong-Jian; Xue, Huai-Guo
• Journal of publication: New J. Chem.
• Year of publication: 2016
• Journal volume: 40
• Journal issue: 8
• Pages of publication: 6720
• a: 3.9725 ± 0.0005 Å
• b: 7.5945 ± 0.0008 Å
• c: 11.1824 ± 0.0014 Å
• α: 91.402 ± 0.007°
• β: 91.093 ± 0.007°
• γ: 90.206 ± 0.007°
• Cell volume: 337.2 ± 0.07 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.0523
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.084
• Weighted residual factors for all reflections included in the refinement: 0.0897
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No