Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-100637
- Created at: Sept. 4, 2022, 2:36 p.m.
- Last updated at: Sept. 4, 2022, 2:36 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 4
- Number of elements: 3
- Element list: ['Ta', 'O', 'F']
- Chemical System: F-O-Ta
- Density: 6.226752583485702
- Atomic Density: 0.06466768776653799
- Unit Cell Volume: 61.85469340485346
- Molar Volume: 9.312441758766779
- Full Formula: Ta1 O2 F1
- Reduced Formula: TaO2F
- Formula Anonymous: ABC2
- Spacegroup Number: 123
- Spacegroup Symbol: P4/mmm
- Crystal System: tetragonal
- Pointgroup: 4/mmm