Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-59313
- 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: 80
- Number of elements: 4
- Element list: ['Ca', 'Al', 'Si', 'O']
- Chemical System: Al-Ca-O-Si
- Density: 3.5218327231965616
- Atomic Density: 0.09416868898548741
- Unit Cell Volume: 849.5392774590821
- Molar Volume: 6.395056387509109
- Full Formula: Ca12 Al8 Si12 O48
- Reduced Formula: Ca3Al2(SiO4)3
- Formula Anonymous: A2B3C3D12
- Spacegroup Number: 230
- Spacegroup Symbol: Ia-3d
- Crystal System: cubic
- Pointgroup: m-3m
