Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-63994
- 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: 6
- Number of elements: 3
- Element list: ['Ba', 'Zr', 'P']
- Chemical System: Ba-P-Zr
- Density: 4.694167557100143
- Atomic Density: 0.02525870012384335
- Unit Cell Volume: 237.5419150859709
- Molar Volume: 23.84184748412807
- Full Formula: Ba4 Zr1 P1
- Reduced Formula: Ba4ZrP
- Formula Anonymous: ABC4
- Spacegroup Number: 216
- Spacegroup Symbol: F-43m
- Crystal System: cubic
- Pointgroup: -43m