Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-21236
- 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: 20
- Number of elements: 3
- Element list: ['Ca', 'C', 'O']
- Chemical System: C-Ca-O
- Density: 2.9329830361537144
- Atomic Density: 0.08823750509064492
- Unit Cell Volume: 226.66098706501657
- Molar Volume: 6.824921844530346
- Full Formula: Ca4 C4 O12
- Reduced Formula: CaCO3
- Formula Anonymous: ABC3
- Spacegroup Number: 62
- Spacegroup Symbol: Pnma
- Crystal System: orthorhombic
- Pointgroup: mmm
