Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-4864
- 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: 24
- Number of elements: 4
- Element list: ['Ba', 'B', 'O', 'F']
- Chemical System: B-Ba-F-O
- Density: 4.511129849840944
- Atomic Density: 0.07371140511815688
- Unit Cell Volume: 325.5941188684277
- Molar Volume: 8.169890060224347
- Full Formula: Ba4 B4 O4 F12
- Reduced Formula: BaBOF3
- Formula Anonymous: ABCD3
- Spacegroup Number: 62
- Spacegroup Symbol: Pnma
- Crystal System: orthorhombic
- Pointgroup: mmm
