Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-20841
- 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: 32
- Number of elements: 3
- Element list: ['Ca', 'Ta', 'O']
- Chemical System: Ca-O-Ta
- Density: 7.4215351007767145
- Atomic Density: 0.07608518748262275
- Unit Cell Volume: 420.58120718055073
- Molar Volume: 7.914997595787497
- Full Formula: Ca2 Ta8 O22
- Reduced Formula: CaTa4O11
- Formula Anonymous: AB4C11
- Spacegroup Number: 182
- Spacegroup Symbol: P6_322
- Crystal System: hexagonal
- Pointgroup: 622
