Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-25025
- 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: 42
- Number of elements: 4
- Element list: ['Ba', 'P', 'Cl', 'O']
- Chemical System: Ba-Cl-O-P
- Density: 4.684531643233837
- Atomic Density: 0.05883096930938477
- Unit Cell Volume: 713.9097059429229
- Molar Volume: 10.236344616948784
- Full Formula: Ba10 P6 Cl2 O24
- Reduced Formula: Ba5P3ClO12
- Formula Anonymous: AB3C5D12
- Spacegroup Number: 176
- Spacegroup Symbol: P6_3/m
- Crystal System: hexagonal
- Pointgroup: 6/m
