Information card for entry 7245028

Structure parameters

• Formula: Cd Ge2 O S6 Sr2
• Calculated formula: Cd Ge2 O S6 Sr2
• Title of publication: From oxides to oxysulfides: the mixed-anion GeS3O unit induces huge improvement in the nonlinear optical effect and optical anisotropy for potential nonlinear optical materials
• Authors of publication: Tian, Xinyu; Zhang, Xiaodong; Xiao, Yan; Wu, Xiaowen; Zhang, Bingbing; Yang, Daqing; Wu, Kui
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 25
• Pages of publication: 16296 - 16300
• a: 9.608 ± 0.0002 Å
• b: 9.608 ± 0.0002 Å
• c: 6.2085 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 573.13 ± 0.03 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 5
• Space group number: 113
• Hermann-Mauguin space group symbol: P -4 21 m
• Hall space group symbol: P -4 2ab
• Residual factor for all reflections: 0.0102
• Residual factor for significantly intense reflections: 0.01
• Weighted residual factors for significantly intense reflections: 0.0231
• Weighted residual factors for all reflections included in the refinement: 0.0232
• Goodness-of-fit parameter for all reflections included in the refinement: 0.877
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No