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-1173391
- Created at: Sept. 4, 2022, 2:46 p.m.
- Last updated at: Nov. 28, 2021, 1:37 a.m.
- Input Source: Materials Project
Structure:
- Number of sites: 72
- Number of elements: 5
- Element list: ['P', 'H', 'Au', 'C', 'I']
- Chemical System: Au-C-H-I-P
- Density: 1.7746404768465707
- Atomic Density: 0.07602071976783788
- Unit Cell Volume: 947.110211793352
- Molar Volume: 7.921709737018025
- Full Formula: P4 H48 Au2 C16 I2
- Reduced Formula: P2H24AuC8I
- Formula Anonymous: ABC2D8E24
- Spacegroup Number: 63
- Spacegroup Symbol: Cmcm
- Crystal System: orthorhombic
- Pointgroup: mmm
