Information card for entry 7711805

Structure parameters

• Chemical name: Barium Iron silver sulphur (4-1-1-6)
• Formula: Ag Ba4 Fe S6
• Calculated formula: Ag Ba4 Fe S6
• Title of publication: Ba₄FeAgS₆: a new antiferromagnetic and semiconducting quaternary sulfide.
• Authors of publication: Panigrahi, Gopabandhu; Yadav, Sweta; Jana, Subhendu; Ramanujachary, K. V.; Niranjan, Manish K.; Prakash, Jai
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 621 - 634
• a: 8.6367 ± 0.0005 Å
• b: 12.0291 ± 0.0007 Å
• c: 13.251 ± 0.0007 Å
• α: 90°
• β: 109.015 ± 0.002°
• γ: 90°
• Cell volume: 1301.55 ± 0.13 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0161
• Residual factor for significantly intense reflections: 0.0155
• Weighted residual factors for significantly intense reflections: 0.0341
• Weighted residual factors for all reflections included in the refinement: 0.0343
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No