Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-1387216
- 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: 5.064563568802904
- Atomic Density: 0.07123112826722128
- Unit Cell Volume: 112.31044902150445
- Molar Volume: 8.454366660328802
- Full Formula: Ba1 Zr1 F6
- Reduced Formula: BaZrF6
- Formula Anonymous: ABC6
- Spacegroup Number: 166
- Spacegroup Symbol: R-3mH
- Crystal System: trigonal
- Pointgroup: -3m
