Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-112430
- 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: 12
- Number of elements: 3
- Element list: ['Cr', 'O', 'F']
- Chemical System: Cr-F-O
- Density: 4.388314711371126
- Atomic Density: 0.09113414134125776
- Unit Cell Volume: 131.6740337198681
- Molar Volume: 6.6079963791502685
- Full Formula: Cr4 O4 F4
- Reduced Formula: CrOF
- Formula Anonymous: ABC
- Spacegroup Number: 59
- Spacegroup Symbol: Pmmn1
- Crystal System: orthorhombic
- Pointgroup: mmm