Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-118340
- 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: 6
- Number of elements: 3
- Element list: ['Ti', 'O', 'F']
- Chemical System: F-O-Ti
- Density: 3.4266414944367147
- Atomic Density: 0.08852730816003151
- Unit Cell Volume: 67.7756968409539
- Molar Volume: 6.8025797747218615
- Full Formula: Ti1 O1 F4
- Reduced Formula: TiOF4
- Formula Anonymous: ABC4
- Spacegroup Number: 79
- Spacegroup Symbol: I4
- Crystal System: tetragonal
- Pointgroup: 4
