Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-50799
- 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: 18
- Number of elements: 3
- Element list: ['Ba', 'Ca', 'I']
- Chemical System: Ba-Ca-I
- Density: 3.903910799057311
- Atomic Density: 0.019661512711551764
- Unit Cell Volume: 915.4941567351747
- Molar Volume: 30.629081537870693
- Full Formula: Ba4 Ca2 I12
- Reduced Formula: Ba2CaI6
- Formula Anonymous: AB2C6
- Spacegroup Number: 136
- Spacegroup Symbol: P4_2/mnm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
