Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-12507
- 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: 12
- Number of elements: 2
- Element list: ['Ba', 'I']
- Chemical System: Ba-I
- Density: 5.1254798321759845
- Atomic Density: 0.023674398999927015
- Unit Cell Volume: 506.8766476410655
- Molar Volume: 25.437354333761817
- Full Formula: Ba4 I8
- Reduced Formula: BaI2
- Formula Anonymous: AB2
- Spacegroup Number: 62
- Spacegroup Symbol: Pnma
- Crystal System: orthorhombic
- Pointgroup: mmm