Table mix-ins: ['Structure', 'Thermodynamics']
Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']
Base Information:
- Database Entry ID: mp-39511
- Created at: Sept. 4, 2022, 2:47 p.m.
- Last updated at: Nov. 28, 2021, 1:38 a.m.
- Input Source: Materials Project
Structure:
- Number of sites: 22
- Number of elements: 5
- Element list: ['Li', 'Ca', 'Ta', 'O', 'F']
- Chemical System: Ca-F-Li-O-Ta
- Density: 6.077333360996901
- Atomic Density: 0.07684229394081121
- Unit Cell Volume: 286.3006668820401
- Molar Volume: 7.837013252934163
- Full Formula: Li2 Ca2 Ta4 O12 F2
- Reduced Formula: LiCaTa2O6F
- Formula Anonymous: ABCD2E6
- Spacegroup Number: 74
- Spacegroup Symbol: Imma
- Crystal System: orthorhombic
- Pointgroup: mmm
