Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-59785
- 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: 20
- Number of elements: 3
- Element list: ['Nb', 'Fe', 'S']
- Chemical System: Fe-Nb-S
- Density: 5.200245500619353
- Atomic Density: 0.05942947976859764
- Unit Cell Volume: 336.53331777216636
- Molar Volume: 10.133255050268977
- Full Formula: Nb6 Fe2 S12
- Reduced Formula: Nb3FeS6
- Formula Anonymous: AB3C6
- Spacegroup Number: 182
- Spacegroup Symbol: P6_322
- Crystal System: hexagonal
- Pointgroup: 622
