Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-91342
- 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: 30
- Number of elements: 3
- Element list: ['Mo', 'S', 'Br']
- Chemical System: Br-Mo-S
- Density: 5.4590869477215085
- Atomic Density: 0.04283404954699861
- Unit Cell Volume: 700.37739408886
- Molar Volume: 14.059237507750359
- Full Formula: Mo12 S6 Br12
- Reduced Formula: Mo2SBr2
- Formula Anonymous: AB2C2
- Spacegroup Number: 63
- Spacegroup Symbol: Cmcm
- Crystal System: orthorhombic
- Pointgroup: mmm
