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-781992
- Created at: Sept. 4, 2022, 2:45 p.m.
- Last updated at: Nov. 28, 2021, 1:37 a.m.
- Input Source: Materials Project
Structure:
- Number of sites: 56
- Number of elements: 4
- Element list: ['P', 'H', 'N', 'Cl']
- Chemical System: Cl-H-N-P
- Density: 1.4130229433378907
- Atomic Density: 0.09127688198517446
- Unit Cell Volume: 613.5178895472759
- Molar Volume: 6.597662660056836
- Full Formula: P4 H32 N16 Cl4
- Reduced Formula: PH8N4Cl
- Formula Anonymous: ABC4D8
- Spacegroup Number: 60
- Spacegroup Symbol: Pbcn
- Crystal System: orthorhombic
- Pointgroup: mmm
