Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-117993
- 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: ['Ca', 'Ti', 'O']
- Chemical System: Ca-O-Ti
- Density: 3.94963863153854
- Atomic Density: 0.08107641510844789
- Unit Cell Volume: 74.0042587227666
- Molar Volume: 7.427734381132637
- Full Formula: Ca2 Ti1 O3
- Reduced Formula: Ca2TiO3
- Formula Anonymous: AB2C3
- Spacegroup Number: 139
- Spacegroup Symbol: I4/mmm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
