Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-98034
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 56
- Number of elements: 3
- Element list: ['C', 'O', 'F']
- Chemical System: C-F-O
- Density: 2.1556645522544295
- Atomic Density: 0.08259859648218183
- Unit Cell Volume: 677.9776217151622
- Molar Volume: 7.290851196604892
- Full Formula: C16 O24 F16
- Reduced Formula: C2O3F2
- Formula Anonymous: A2B2C3
- Spacegroup Number: 19
- Spacegroup Symbol: P2_12_121
- Crystal System: orthorhombic
- Pointgroup: 222
