Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-2218
- Created at: Sept. 4, 2022, 2:48 p.m.
- Last updated at: Sept. 4, 2022, 2:48 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 8
- Number of elements: 3
- Element list: ['Cu', 'Fe', 'S']
- Chemical System: Cu-Fe-S
- Density: 4.2727849942119915
- Atomic Density: 0.05608363660017675
- Unit Cell Volume: 142.6441023614861
- Molar Volume: 10.737785787558972
- Full Formula: Fe2 Cu2 S4
- Reduced Formula: FeCuS2
- Formula Anonymous: ABC2
- Spacegroup Number: 122
- Spacegroup Symbol: I-42d
- Crystal System: tetragonal
- Pointgroup: -42m
