Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-11400
- Created at: Sept. 4, 2022, 2:37 p.m.
- Last updated at: Sept. 4, 2022, 2:37 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 16
- Number of elements: 4
- Element list: ['Ca', 'Ta', 'Al', 'O']
- Chemical System: Al-Ca-O-Ta
- Density: 5.309464411301051
- Atomic Density: 0.07798514957228718
- Unit Cell Volume: 205.1672669444461
- Molar Volume: 7.7221635055246844
- Full Formula: Ca2 Ta2 Al2 O10
- Reduced Formula: CaTaAlO5
- Formula Anonymous: ABCD5
- Spacegroup Number: 15
- Spacegroup Symbol: C12/c1
- Crystal System: monoclinic
- Pointgroup: 2/m
