Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-1741879
- Created at: Sept. 4, 2022, 4:03 p.m.
- Last updated at: Sept. 4, 2022, 4:03 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 5
- Number of elements: 3
- Element list: ['As', 'Ba', 'Ti']
- Chemical System: As-Ba-Ti
- Density: 5.084155760744475
- Atomic Density: 0.03998062915939401
- Unit Cell Volume: 125.06056320589893
- Molar Volume: 15.062646303016006
- Full Formula: Ba1 Ti2 As2
- Reduced Formula: Ba(TiAs)2
- Formula Anonymous: AB2C2
- Spacegroup Number: 164
- Spacegroup Symbol: P-3m1
- Crystal System: trigonal
- Pointgroup: -3m1
