Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-4498
- 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: 10
- Number of elements: 3
- Element list: ['Fe', 'P', 'S']
- Chemical System: Fe-P-S
- Density: 3.1501589860714825
- Atomic Density: 0.05182861832285929
- Unit Cell Volume: 192.94359609793895
- Molar Volume: 11.61933494442375
- Full Formula: Fe2 P2 S6
- Reduced Formula: FePS3
- Formula Anonymous: ABC3
- Spacegroup Number: 12
- Spacegroup Symbol: C12/m1
- Crystal System: monoclinic
- Pointgroup: 2/m
