Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-66543
- Created at: Sept. 4, 2022, 2:36 p.m.
- Last updated at: Sept. 4, 2022, 2:36 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 6
- Number of elements: 3
- Element list: ['Ba', 'Fe', 'Se']
- Chemical System: Ba-Fe-Se
- Density: 4.974275656391567
- Atomic Density: 0.026272666818654367
- Unit Cell Volume: 228.3742279158286
- Molar Volume: 22.92169577442402
- Full Formula: Ba4 Fe1 Se1
- Reduced Formula: Ba4FeSe
- Formula Anonymous: ABC4
- Spacegroup Number: 216
- Spacegroup Symbol: F-43m
- Crystal System: cubic
- Pointgroup: -43m