Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-55611
- 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: 22
- Number of elements: 3
- Element list: ['Ba', 'Cl', 'O']
- Chemical System: Ba-Cl-O
- Density: 3.9158611591345154
- Atomic Density: 0.033340882978347
- Unit Cell Volume: 659.8505508773641
- Molar Volume: 18.062331354304675
- Full Formula: Ba8 Cl12 O2
- Reduced Formula: Ba4Cl6O
- Formula Anonymous: AB4C6
- Spacegroup Number: 186
- Spacegroup Symbol: P6_3mc
- Crystal System: hexagonal
- Pointgroup: 6mm
