Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-118319
- 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: 3
- Number of elements: 3
- Element list: ['Ta', 'O', 'F']
- Chemical System: F-O-Ta
- Density: 6.0714903359714185
- Atomic Density: 0.05079523086132488
- Unit Cell Volume: 59.06066276557034
- Molar Volume: 11.855720818438515
- Full Formula: Ta1 O1 F1
- Reduced Formula: TaOF
- Formula Anonymous: ABC
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm