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-1233666
- 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: 31
- Number of elements: 6
- Element list: ['Ba', 'Mg', 'Sc', 'C', 'O', 'F']
- Chemical System: Ba-C-F-Mg-O-Sc
- Density: 4.170016568096642
- Atomic Density: 0.05879023990229201
- Unit Cell Volume: 527.2984095918177
- Molar Volume: 10.243436274471165
- Full Formula: Ba6 Mg1 Sc2 C2 O6 F14
- Reduced Formula: Ba6MgSc2C2(O3F7)2
- Formula Anonymous: AB2C2D6E6F14
- Spacegroup Number: 8
- Spacegroup Symbol: C1m1
- Crystal System: monoclinic
- Pointgroup: m