Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-32676
- Created at: Sept. 4, 2022, 2:36 p.m.
- Last updated at: Sept. 4, 2022, 2:36 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 28
- Number of elements: 5
- Element list: ['As', 'Pb', 'S', 'I', 'Cl']
- Chemical System: As-Cl-I-Pb-S
- Density: 5.938639490929958
- Atomic Density: 0.0375498743586436
- Unit Cell Volume: 745.6749317605822
- Molar Volume: 16.037712143805788
- Full Formula: As4 Pb8 S12 I2 Cl2
- Reduced Formula: As2Pb4S6ICl
- Formula Anonymous: ABC2D4E6
- Spacegroup Number: 31
- Spacegroup Symbol: Pmn2_1
- Crystal System: orthorhombic
- Pointgroup: mm2
