Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-23920
- 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: 6
- Number of elements: 3
- Element list: ['Ba', 'Cl', 'F']
- Chemical System: Ba-Cl-F
- Density: 4.504811916981914
- Atomic Density: 0.042437434588201206
- Unit Cell Volume: 141.38460673275873
- Molar Volume: 14.190633384031946
- Full Formula: Ba2 Cl2 F2
- Reduced Formula: BaClF
- Formula Anonymous: ABC
- Spacegroup Number: 129
- Spacegroup Symbol: P4/nmm1
- Crystal System: tetragonal
- Pointgroup: 4/mmm
