Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-1384655
- Created at: Sept. 4, 2022, 3:47 p.m.
- Last updated at: Sept. 4, 2022, 3:47 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 8
- Number of elements: 3
- Element list: ['Ba', 'F', 'Zr']
- Chemical System: Ba-F-Zr
- Density: 5.279630242634766
- Atomic Density: 0.07425595787427525
- Unit Cell Volume: 107.73546297180644
- Molar Volume: 8.10997653574983
- Full Formula: Ba1 Zr1 F6
- Reduced Formula: BaZrF6
- Formula Anonymous: ABC6
- Spacegroup Number: 148
- Spacegroup Symbol: R-3H
- Crystal System: trigonal
- Pointgroup: -3
