Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-49852
- 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: 3.909334792727094
- Atomic Density: 0.0216448007101547
- Unit Cell Volume: 831.6084883865558
- Molar Volume: 27.82257430152591
- Full Formula: Ba2 Ca4 I12
- Reduced Formula: BaCa2I6
- Formula Anonymous: AB2C6
- Spacegroup Number: 136
- Spacegroup Symbol: P4_2/mnm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
