Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-99237
- 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: 38
- Number of elements: 5
- Element list: ['Ca', 'Al', 'Si', 'H', 'O']
- Chemical System: Al-Ca-H-O-Si
- Density: 3.0295832172314587
- Atomic Density: 0.11031356319032173
- Unit Cell Volume: 344.47260065781194
- Molar Volume: 5.459111813485821
- Full Formula: Ca2 Al4 Si4 H8 O20
- Reduced Formula: CaAl2Si2(H2O5)2
- Formula Anonymous: AB2C2D4E10
- Spacegroup Number: 63
- Spacegroup Symbol: Cmcm
- Crystal System: orthorhombic
- Pointgroup: mmm
