Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-91586
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 8
- Number of elements: 4
- Element list: ['Ca', 'Fe', 'As', 'F']
- Chemical System: As-Ca-F-Fe
- Density: 5.0526186586719595
- Atomic Density: 0.06411103968384768
- Unit Cell Volume: 124.78350124176106
- Molar Volume: 9.393297612543998
- Full Formula: Ca2 Fe2 As2 F2
- Reduced Formula: CaFeAsF
- Formula Anonymous: ABCD
- Spacegroup Number: 129
- Spacegroup Symbol: P4/nmm1
- Crystal System: tetragonal
- Pointgroup: 4/mmm
