Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-117560
- 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', 'Se', 'Cl']
- Chemical System: Ba-Cl-Se
- Density: 0.8457526592991935
- Atomic Density: 0.006069645146823129
- Unit Cell Volume: 494.26283208174186
- Molar Volume: 99.21734490774978
- Full Formula: Ba1 Se1 Cl1
- Reduced Formula: BaSeCl
- Formula Anonymous: ABC
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm
