Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-114723
- 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', 'O']
- Chemical System: Ca-O-Zr
- Density: 4.348432186436806
- Atomic Density: 0.06414388838532728
- Unit Cell Volume: 62.35979920598309
- Molar Volume: 9.388487214594159
- Full Formula: Ca1 Zr1 O2
- Reduced Formula: CaZrO2
- Formula Anonymous: ABC2
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm