Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-91438
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 31
- Number of elements: 4
- Element list: ['Ca', 'Th', 'Si', 'O']
- Chemical System: Ca-O-Si-Th
- Density: 3.3191002324983714
- Atomic Density: 0.07231360673923794
- Unit Cell Volume: 428.68833955116713
- Molar Volume: 8.327811364347754
- Full Formula: Ca2 Th1 Si8 O20
- Reduced Formula: Ca2Th(Si2O5)4
- Formula Anonymous: AB2C8D20
- Spacegroup Number: 97
- Spacegroup Symbol: I422
- Crystal System: tetragonal
- Pointgroup: 422
