Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-91820
- 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: ['Ba', 'Cu', 'Se', 'O']
- Chemical System: Ba-Cu-O-Se
- Density: 5.582854697245756
- Atomic Density: 0.04545916788162452
- Unit Cell Volume: 175.98210378227702
- Molar Volume: 13.247362502722508
- Full Formula: Ba2 Cu2 Se2 O2
- Reduced Formula: BaCuSeO
- Formula Anonymous: ABCD
- Spacegroup Number: 129
- Spacegroup Symbol: P4/nmm1
- Crystal System: tetragonal
- Pointgroup: 4/mmm