Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-58506
- 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: 22
- Number of elements: 3
- Element list: ['Al', 'Cu', 'Se']
- Chemical System: Al-Cu-Se
- Density: 4.80893787445372
- Atomic Density: 0.04434554138127495
- Unit Cell Volume: 496.10398959498485
- Molar Volume: 13.580036622448064
- Full Formula: Al4 Cu6 Se12
- Reduced Formula: Al2(CuSe2)3
- Formula Anonymous: A2B3C6
- Spacegroup Number: 122
- Spacegroup Symbol: I-42d
- Crystal System: tetragonal
- Pointgroup: -42m