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-19054
- 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: 16
- Number of elements: 5
- Element list: ['Ba', 'Mn', 'C', 'O', 'F']
- Chemical System: Ba-C-F-Mn-O
- Density: 4.4248023736030175
- Atomic Density: 0.07343980090231866
- Unit Cell Volume: 217.86551438614867
- Molar Volume: 8.200104964894951
- Full Formula: Ba2 Mn2 C2 O6 F4
- Reduced Formula: BaMnCO3F2
- Formula Anonymous: ABCD2E3
- Spacegroup Number: 176
- Spacegroup Symbol: P6_3/m
- Crystal System: hexagonal
- Pointgroup: 6/m