Information card for entry 1000129

Structure parameters

• Chemical name: Barium catena-pentafluoroaluminate - α
• Formula: Al Ba F5
• Calculated formula: Al Ba F5
• Title of publication: Structure determination of β- and γ-BaAlF~5~ by X-ray and neutron powder diffraction: a model for the α→ β ←→ γ transitions
• Authors of publication: Le Bail, A.; Ferey, G.; Mercier, A.-M.; de Kozak, A.; Samouel, M.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 1990
• Journal volume: 89
• Pages of publication: 282 - 291
• a: 13.7168 ± 0.0003 Å
• b: 5.6054 ± 0.0002 Å
• c: 4.9329 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 379.3 ų
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.027
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No