Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-96072
- 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', 'Al', 'Cl']
- Chemical System: Al-Ba-Cl
- Density: 2.4188359666470327
- Atomic Density: 0.0337392141188067
- Unit Cell Volume: 652.060238348495
- Molar Volume: 17.84908426969903
- Full Formula: Ba2 Al4 Cl16
- Reduced Formula: Ba(AlCl4)2
- Formula Anonymous: AB2C8
- Spacegroup Number: 13
- Spacegroup Symbol: P12/c1
- Crystal System: monoclinic
- Pointgroup: 2/m