Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-121801
- 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: 16
- Number of elements: 5
- Element list: ['Ca', 'Fe', 'Cu', 'S', 'O']
- Chemical System: Ca-Cu-Fe-O-S
- Density: 4.322110720903346
- Atomic Density: 0.07447041388498667
- Unit Cell Volume: 214.85042401819686
- Molar Volume: 8.086621848645414
- Full Formula: Ca4 Fe2 Cu2 S2 O6
- Reduced Formula: Ca2FeCuSO3
- Formula Anonymous: ABCD2E3
- Spacegroup Number: 129
- Spacegroup Symbol: P4/nmm1
- Crystal System: tetragonal
- Pointgroup: 4/mmm
