Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-15673
- 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: 7
- Number of elements: 4
- Element list: ['Ba', 'Pd', 'O', 'F']
- Chemical System: Ba-F-O-Pd
- Density: 6.02701244135257
- Atomic Density: 0.056325812573408546
- Unit Cell Volume: 124.2769465753736
- Molar Volume: 10.691618078569999
- Full Formula: Ba2 Pd1 O2 F2
- Reduced Formula: Ba2Pd(OF)2
- Formula Anonymous: AB2C2D2
- Spacegroup Number: 139
- Spacegroup Symbol: I4/mmm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
