Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-43490
- 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: 24
- Number of elements: 2
- Element list: ['Zr', 'O']
- Chemical System: O-Zr
- Density: 5.031306944650313
- Atomic Density: 0.073766961888353
- Unit Cell Volume: 325.34890126455565
- Molar Volume: 8.163736998027067
- Full Formula: Zr8 O16
- Reduced Formula: ZrO2
- Formula Anonymous: AB2
- Spacegroup Number: 61
- Spacegroup Symbol: Pbca
- Crystal System: orthorhombic
- Pointgroup: mmm