Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-9254
- Created at: Sept. 4, 2022, 2:38 p.m.
- Last updated at: Sept. 4, 2022, 2:38 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 16
- Number of elements: 3
- Element list: ['Ca', 'Ti', 'O']
- Chemical System: Ca-O-Ti
- Density: 3.90962899927012
- Atomic Density: 0.07851789308365759
- Unit Cell Volume: 203.77520806566548
- Molar Volume: 7.669768664810781
- Full Formula: Ca4 Ti4 O8
- Reduced Formula: CaTiO2
- Formula Anonymous: ABC2
- Spacegroup Number: 12
- Spacegroup Symbol: C12/m1
- Crystal System: monoclinic
- Pointgroup: 2/m