Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-120044
- 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: ['C', 'Cl', 'F']
- Chemical System: C-Cl-F
- Density: 2.4584489355893546
- Atomic Density: 0.06929575388758803
- Unit Cell Volume: 57.72359452916586
- Molar Volume: 8.690490285695068
- Full Formula: C1 Cl1 F2
- Reduced Formula: CClF2
- Formula Anonymous: ABC2
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm
