Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-20975
- 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: 56
- Number of elements: 3
- Element list: ['Ba', 'Al', 'O']
- Chemical System: Al-Ba-O
- Density: 3.9797353341717563
- Atomic Density: 0.06571632696396829
- Unit Cell Volume: 852.1474432176395
- Molar Volume: 9.163842591662023
- Full Formula: Ba8 Al16 O32
- Reduced Formula: BaAl2O4
- Formula Anonymous: AB2C4
- Spacegroup Number: 173
- Spacegroup Symbol: P6_3
- Crystal System: hexagonal
- Pointgroup: 6
