Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-115672
- Created at: Sept. 4, 2022, 2:38 p.m.
- Last updated at: Sept. 4, 2022, 2:38 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 3
- Number of elements: 3
- Element list: ['Br', 'Cl', 'F']
- Chemical System: Br-Cl-F
- Density: 3.5046520044718714
- Atomic Density: 0.04712614570838347
- Unit Cell Volume: 63.65892977040805
- Molar Volume: 12.778767856945057
- Full Formula: Br1 Cl1 F1
- Reduced Formula: BrClF
- Formula Anonymous: ABC
- Spacegroup Number: 187
- Spacegroup Symbol: P-6m2
- Crystal System: hexagonal
- Pointgroup: -6m2
