Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-82
- 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: 3
- Number of elements: 2
- Element list: ['Zr', 'S']
- Chemical System: S-Zr
- Density: 3.7522835977580384
- Atomic Density: 0.043636044141020694
- Unit Cell Volume: 68.75050337525455
- Molar Volume: 13.800840288221266
- Full Formula: Zr1 S2
- Reduced Formula: ZrS2
- Formula Anonymous: AB2
- Spacegroup Number: 164
- Spacegroup Symbol: P-3m1
- Crystal System: trigonal
- Pointgroup: -3m1