Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-35827
- 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: 6
- Number of elements: 3
- Element list: ['Ba', 'Cl', 'F']
- Chemical System: Ba-Cl-F
- Density: 4.848824298500466
- Atomic Density: 0.04772562249840905
- Unit Cell Volume: 125.71863258986326
- Molar Volume: 12.618255026847999
- Full Formula: Ba2 Cl1 F3
- Reduced Formula: Ba2ClF3
- Formula Anonymous: AB2C3
- Spacegroup Number: 164
- Spacegroup Symbol: P-3m1
- Crystal System: trigonal
- Pointgroup: -3m1
