Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-65710
- 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: 4
- Number of elements: 3
- Element list: ['Ba', 'Ca', 'Y']
- Chemical System: Ba-Ca-Y
- Density: 3.0535232274083097
- Atomic Density: 0.02400707035616615
- Unit Cell Volume: 166.61758143148904
- Molar Volume: 25.08486321177973
- Full Formula: Ba1 Ca2 Y1
- Reduced Formula: BaCa2Y
- Formula Anonymous: ABC2
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm
