Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-675876
- Created at: Sept. 4, 2022, 3:31 p.m.
- Last updated at: Sept. 4, 2022, 3:31 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 84
- Number of elements: 3
- Element list: ['Ba', 'Bi', 'S']
- Chemical System: Ba-Bi-S
- Density: 5.714061397125407
- Atomic Density: 0.03523911193871766
- Unit Cell Volume: 2383.715008087594
- Molar Volume: 17.089365845747654
- Full Formula: Ba12 Bi24 S48
- Reduced Formula: Ba(BiS2)2
- Formula Anonymous: AB2C4
- Spacegroup Number: 176
- Spacegroup Symbol: P6_3/m
- Crystal System: hexagonal
- Pointgroup: 6/m
