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-684055
- 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: 156
- Number of elements: 3
- Element list: ['Tl', 'Bi', 'I']
- Chemical System: Bi-I-Tl
- Density: 5.901621459618807
- Atomic Density: 0.02260343971127665
- Unit Cell Volume: 6901.60444572394
- Molar Volume: 26.642585539738043
- Full Formula: Tl42 Bi18 I96
- Reduced Formula: Tl7Bi3I16
- Formula Anonymous: A3B7C16
- Spacegroup Number: 63
- Spacegroup Symbol: Cmcm
- Crystal System: orthorhombic
- Pointgroup: mmm