Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-114530
- 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: ['Ba', 'Bi', 'Cl']
- Chemical System: Ba-Bi-Cl
- Density: 5.227522406008514
- Atomic Density: 0.024738717608675173
- Unit Cell Volume: 121.26740146578916
- Molar Volume: 24.34297870754709
- Full Formula: Ba1 Bi1 Cl1
- Reduced Formula: BaBiCl
- Formula Anonymous: ABC
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm