Information card for entry 2300250

Structure parameters

• Formula: Al
• Calculated formula: Al
• SMILES: [Al]
• Title of publication: Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa
• Authors of publication: Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F.
• Journal of publication: Journal of Applied Crystallography
• Year of publication: 2009
• Journal volume: 42
• Journal issue: 5
• Pages of publication: 846 - 866
• a: 4.03702 ± 0.00012 Å
• b: 4.03702 Å
• c: 4.03702 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 65.793 ± 0.002 ų
• Number of distinct elements: 1
• Space group number: 225
• Hermann-Mauguin space group symbol: F m -3 m
• Hall space group symbol: -F 4 2 3
• Method of determination: powder diffraction
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No