Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-98480
- 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: 12
- Number of elements: 3
- Element list: ['Ba', 'Fe', 'S']
- Chemical System: Ba-Fe-S
- Density: 4.812786216237074
- Atomic Density: 0.05037474256743704
- Unit Cell Volume: 238.21461685755537
- Molar Volume: 11.954682948380562
- Full Formula: Ba2 Fe4 S6
- Reduced Formula: BaFe2S3
- Formula Anonymous: AB2C3
- Spacegroup Number: 63
- Spacegroup Symbol: Cmcm
- Crystal System: orthorhombic
- Pointgroup: mmm
