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-863012
- 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: 72
- Number of elements: 5
- Element list: ['Cd', 'H', 'C', 'N', 'Cl']
- Chemical System: C-Cd-Cl-H-N
- Density: 2.0224514310440136
- Atomic Density: 0.07860883667360262
- Unit Cell Volume: 915.9275603957396
- Molar Volume: 7.660895409259091
- Full Formula: Cd4 H40 C12 N4 Cl12
- Reduced Formula: CdH10C3NCl3
- Formula Anonymous: ABC3D3E10
- Spacegroup Number: 62
- Spacegroup Symbol: Pnma
- Crystal System: orthorhombic
- Pointgroup: mmm
