Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-65793
- 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: 4
- Number of elements: 3
- Element list: ['Ba', 'Se', 'Cl']
- Chemical System: Ba-Cl-Se
- Density: 5.12666411774115
- Atomic Density: 0.03734320285085896
- Unit Cell Volume: 107.11454012059903
- Molar Volume: 16.126470951222867
- Full Formula: Ba1 Se2 Cl1
- Reduced Formula: BaSe2Cl
- Formula Anonymous: ABC2
- Spacegroup Number: 123
- Spacegroup Symbol: P4/mmm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
