Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-86295
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 16
- Number of elements: 2
- Element list: ['Zr', 'I']
- Chemical System: I-Zr
- Density: 5.139841962612958
- Atomic Density: 0.02623470921172071
- Unit Cell Volume: 609.8790678743939
- Molar Volume: 22.954859958232465
- Full Formula: Zr4 I12
- Reduced Formula: ZrI3
- Formula Anonymous: AB3
- Spacegroup Number: 193
- Spacegroup Symbol: P6_3/mcm
- Crystal System: hexagonal
- Pointgroup: 6/mmm
