Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-86522
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 11
- Number of elements: 3
- Element list: ['Ba', 'B', 'F']
- Chemical System: B-Ba-F
- Density: 3.6759113097205587
- Atomic Density: 0.0783136182433595
- Unit Cell Volume: 140.46088339090028
- Molar Volume: 7.689774645944978
- Full Formula: Ba1 B2 F8
- Reduced Formula: BaB2F8
- Formula Anonymous: AB2C8
- Spacegroup Number: 12
- Spacegroup Symbol: C12/m1
- Crystal System: monoclinic
- Pointgroup: 2/m
