Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-98052
- 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: 28
- Number of elements: 4
- Element list: ['Ca', 'B', 'Cl', 'O']
- Chemical System: B-Ca-Cl-O
- Density: 2.7753990119268135
- Atomic Density: 0.06707838095184387
- Unit Cell Volume: 417.4221202521485
- Molar Volume: 8.977767016057447
- Full Formula: Ca8 B4 Cl4 O12
- Reduced Formula: Ca2BClO3
- Formula Anonymous: ABC2D3
- Spacegroup Number: 14
- Spacegroup Symbol: P12_1/c1
- Crystal System: monoclinic
- Pointgroup: 2/m
