Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-113569
- Created at: Sept. 4, 2022, 2:38 p.m.
- Last updated at: Sept. 4, 2022, 2:38 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 4
- Number of elements: 3
- Element list: ['Ca', 'Zr', 'S']
- Chemical System: Ca-S-Zr
- Density: 3.6856158778307537
- Atomic Density: 0.045428174733427445
- Unit Cell Volume: 88.05108335239093
- Molar Volume: 13.25640045046477
- Full Formula: Ca1 Zr1 S2
- Reduced Formula: CaZrS2
- Formula Anonymous: ABC2
- Spacegroup Number: 123
- Spacegroup Symbol: P4/mmm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
