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-556173
- Created at: Sept. 4, 2022, 2:41 p.m.
- Last updated at: Nov. 28, 2021, 1:35 a.m.
- Input Source: Materials Project
Structure:
- Number of sites: 51
- Number of elements: 7
- Element list: ['Zn', 'As', 'C', 'S', 'N', 'O', 'F']
- Chemical System: As-C-F-N-O-S-Zn
- Density: 2.2075681010227797
- Atomic Density: 0.058240452362305205
- Unit Cell Volume: 875.6800115963484
- Molar Volume: 10.340133903042439
- Full Formula: Zn1 As2 C6 S12 N12 O6 F12
- Reduced Formula: ZnAs2C6S12N12(OF2)6
- Formula Anonymous: AB2C6D6E12F12G12
- Spacegroup Number: 147
- Spacegroup Symbol: P-3
- Crystal System: trigonal
- Pointgroup: -3