Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-50865
- Created at: Sept. 4, 2022, 2:37 p.m.
- Last updated at: Sept. 4, 2022, 2:37 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 5
- Number of elements: 3
- Element list: ['Li', 'Fe', 'S']
- Chemical System: Fe-Li-S
- Density: 2.7808260952478414
- Atomic Density: 0.06255379315407827
- Unit Cell Volume: 79.9312039748627
- Molar Volume: 9.627139229057894
- Full Formula: Li2 Fe1 S2
- Reduced Formula: Li2FeS2
- Formula Anonymous: AB2C2
- Spacegroup Number: 156
- Spacegroup Symbol: P3m1
- Crystal System: trigonal
- Pointgroup: 3m1