Information card for entry 4511960

Structure parameters

• Formula: Al6 Ca4 O16 S
• Calculated formula: Al6 Ca4 O16 S
• Title of publication: Pseudocubic Crystal Structure and Phase Transition in Doped Ye’elimite
• Authors of publication: Cuesta, Ana; De la Torre, Ángeles G.; Losilla, Enrique R.; Santacruz, Isabel; Aranda, Miguel A. G.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 10
• Pages of publication: 5158
• a: 9.19703 ± 0.00006 Å
• b: 9.19703 Å
• c: 9.19703 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 777.934 ± 0.005 ų
• Cell temperature: 299 K
• Ambient diffraction temperature: 299 K
• Number of distinct elements: 4
• Space group number: 217
• Hermann-Mauguin space group symbol: I -4 3 m
• Hall space group symbol: I -4 2 3
• RFsqd: 0.08441
• Goodness-of-fit parameter for all reflections: 5.64
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.6202 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No