Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-49889
- 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: 5
- Number of elements: 3
- Element list: ['Ba', 'Ta', 'O']
- Chemical System: Ba-O-Ta
- Density: 8.676108680257018
- Atomic Density: 0.07132485376706044
- Unit Cell Volume: 70.10179111378876
- Molar Volume: 8.443257072307063
- Full Formula: Ba1 Ta1 O3
- Reduced Formula: BaTaO3
- Formula Anonymous: ABC3
- Spacegroup Number: 221
- Spacegroup Symbol: Pm-3m
- Crystal System: cubic
- Pointgroup: m-3m
