Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-52354
- 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: 12
- Number of elements: 3
- Element list: ['Ba', 'Ca', 'I']
- Chemical System: Ba-Ca-I
- Density: 4.274615035760859
- Atomic Density: 0.02254727618650664
- Unit Cell Volume: 532.2150622868304
- Molar Volume: 26.708950164028835
- Full Formula: Ba2 Ca2 I8
- Reduced Formula: BaCaI4
- Formula Anonymous: ABC4
- Spacegroup Number: 36
- Spacegroup Symbol: Cmc2_1
- Crystal System: orthorhombic
- Pointgroup: mm2
