Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-30586
- Created at: Sept. 4, 2022, 2:37 p.m.
- Last updated at: Sept. 4, 2022, 2:37 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 3
- Number of elements: 2
- Element list: ['Ti', 'O']
- Chemical System: O-Ti
- Density: 3.797990003145154
- Atomic Density: 0.08591423517419364
- Unit Cell Volume: 34.91854398653974
- Molar Volume: 7.009479567373129
- Full Formula: Ti1 O2
- Reduced Formula: TiO2
- Formula Anonymous: AB2
- Spacegroup Number: 166
- Spacegroup Symbol: R-3mH
- Crystal System: trigonal
- Pointgroup: -3m
