Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-66573
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 3
- Number of elements: 3
- Element list: ['Ba', 'Zr', 'Cl']
- Chemical System: Ba-Cl-Zr
- Density: 3.5950318149869336
- Atomic Density: 0.024601658649881775
- Unit Cell Volume: 121.9429975309578
- Molar Volume: 24.478596527592007
- Full Formula: Ba1 Zr1 Cl1
- Reduced Formula: BaZrCl
- Formula Anonymous: ABC
- Spacegroup Number: 216
- Spacegroup Symbol: F-43m
- Crystal System: cubic
- Pointgroup: -43m
