Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-32971
- Created at: Sept. 4, 2022, 2:37 p.m.
- Last updated at: Sept. 4, 2022, 2:37 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 44
- Number of elements: 3
- Element list: ['Zr', 'Se', 'Cl']
- Chemical System: Cl-Se-Zr
- Density: 3.321167561850379
- Atomic Density: 0.035497307774528496
- Unit Cell Volume: 1239.5306224201236
- Molar Volume: 16.965063373964536
- Full Formula: Zr4 Se16 Cl24
- Reduced Formula: Zr(Se2Cl3)2
- Formula Anonymous: AB4C6
- Spacegroup Number: 138
- Spacegroup Symbol: P4_2/ncm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
