Information card for entry 9014004

Structure parameters

• Mineral name: Carbon
• Formula: C
• Calculated formula: C
• SMILES: [C]
• Title of publication: The carbon allotrope hexagonite and its potential synthesis from cold compression of carbon nanotubes
• Authors of publication: Bucknum, M. J.; Castro, E. A.
• Journal of publication: Journal of Chemical Theory and Computation
• Year of publication: 2006
• Journal volume: 2
• Pages of publication: 775 - 781
• a: 4.89 Å
• b: 4.89 Å
• c: 3.88 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 80.349 ų
• Number of distinct elements: 1
• Space group number: 191
• Hermann-Mauguin space group symbol: P 6/m m m
• Hall space group symbol: -P 6 2
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No