Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-112079
- Created at: Sept. 4, 2022, 2:38 p.m.
- Last updated at: Sept. 4, 2022, 2:38 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 24
- Number of elements: 4
- Element list: ['Ti', 'H', 'C', 'O']
- Chemical System: C-H-O-Ti
- Density: 1.658359979308369
- Atomic Density: 0.11521393370393473
- Unit Cell Volume: 208.30813798678903
- Molar Volume: 5.226920535041444
- Full Formula: Ti1 H12 C7 O4
- Reduced Formula: TiH12C7O4
- Formula Anonymous: AB4C7D12
- Spacegroup Number: 1
- Spacegroup Symbol: P1
- Crystal System: triclinic
- Pointgroup: 1
