Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-25801
- Created at: Sept. 4, 2022, 2:37 p.m.
- Last updated at: Sept. 4, 2022, 2:37 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 42
- Number of elements: 4
- Element list: ['Ba', 'As', 'Cl', 'O']
- Chemical System: As-Ba-Cl-O
- Density: 4.924119050296212
- Atomic Density: 0.054680678316069285
- Unit Cell Volume: 768.0958117825186
- Molar Volume: 11.013288323144744
- Full Formula: Ba10 As6 Cl2 O24
- Reduced Formula: Ba5As3ClO12
- Formula Anonymous: AB3C5D12
- Spacegroup Number: 176
- Spacegroup Symbol: P6_3/m
- Crystal System: hexagonal
- Pointgroup: 6/m
