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-707466
- Created at: Sept. 4, 2022, 2:44 p.m.
- Last updated at: Nov. 28, 2021, 1:36 a.m.
- Input Source: Materials Project
Structure:
- Number of sites: 64
- Number of elements: 6
- Element list: ['H', 'C', 'S', 'N', 'O', 'F']
- Chemical System: C-F-H-N-O-S
- Density: 2.085244848259793
- Atomic Density: 0.07146338507994746
- Unit Cell Volume: 895.5635102983434
- Molar Volume: 8.426889872713021
- Full Formula: H4 C8 S8 N4 O16 F24
- Reduced Formula: HC2S2N(O2F3)2
- Formula Anonymous: ABC2D2E4F6
- Spacegroup Number: 56
- Spacegroup Symbol: Pccn
- Crystal System: orthorhombic
- Pointgroup: mmm
