Information card for entry 1538611

Structure parameters

• Formula: D2 O
• Calculated formula: D2 O
• Title of publication: Disordered structure of D2O ice VII from in situ neutron powder diffraction
• Authors of publication: Jorgensen, James D.; Worlton, Thomas G.
• Journal of publication: Journal of Chemical Physics
• Year of publication: 1985
• Journal volume: 83
• Journal issue: 1
• Pages of publication: 329 - 333
• a: 3.3501 Å
• b: 3.3501 Å
• c: 3.3501 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 37.599 ų
• Ambient diffraction temperature: 295.15 K
• Ambient diffracton pressure: 2600000 kPa
• Number of distinct elements: 2
• Space group number: 224
• Hermann-Mauguin space group symbol: P n -3 m :2
• Hall space group symbol: -P 4bc 2bc 3
• Method of determination: powder diffraction
• Suboptimal structure of: 1566716
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No