Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-59058
- 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: 22
- Number of elements: 3
- Element list: ['Ba', 'I', 'O']
- Chemical System: Ba-I-O
- Density: 5.01139340017463
- Atomic Density: 0.025021777245647255
- Unit Cell Volume: 879.2341081138464
- Molar Volume: 24.06759800024837
- Full Formula: Ba8 I12 O2
- Reduced Formula: Ba4I6O
- Formula Anonymous: AB4C6
- Spacegroup Number: 186
- Spacegroup Symbol: P6_3mc
- Crystal System: hexagonal
- Pointgroup: 6mm
