Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-654577
- Created at: Sept. 4, 2022, 3:51 p.m.
- Last updated at: Sept. 4, 2022, 3:51 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 70
- Number of elements: 4
- Element list: ['Br', 'Cu', 'P', 'S']
- Chemical System: Br-Cu-P-S
- Density: 3.4504419095305674
- Atomic Density: 0.043694895371934224
- Unit Cell Volume: 1602.0177964532186
- Molar Volume: 13.782252386094731
- Full Formula: Cu14 P24 S18 Br14
- Reduced Formula: Cu7P12S9Br7
- Formula Anonymous: A7B7C9D12
- Spacegroup Number: 186
- Spacegroup Symbol: P6_3mc
- Crystal System: hexagonal
- Pointgroup: 6mm
