Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-85787
- 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: 4
- Element list: ['Ba', 'Ca', 'C', 'O']
- Chemical System: Ba-C-Ca-O
- Density: 2.519297834577102
- Atomic Density: 0.0383420672035533
- Unit Cell Volume: 312.9721706524972
- Molar Volume: 15.706353880267324
- Full Formula: Ba2 Ca2 C2 O6
- Reduced Formula: BaCaCO3
- Formula Anonymous: ABCD3
- Spacegroup Number: 186
- Spacegroup Symbol: P6_3mc
- Crystal System: hexagonal
- Pointgroup: 6mm
