Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-120001
- Created at: Sept. 4, 2022, 2:38 p.m.
- Last updated at: Sept. 4, 2022, 2:38 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 4
- Number of elements: 3
- Element list: ['Bi', 'P', 'S']
- Chemical System: Bi-P-S
- Density: 5.5291714034869655
- Atomic Density: 0.04380030616585963
- Unit Cell Volume: 91.32356255349238
- Molar Volume: 13.749083710044903
- Full Formula: Bi1 P1 S2
- Reduced Formula: BiPS2
- Formula Anonymous: ABC2
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm
