Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-98057
- Created at: Sept. 4, 2022, 2:36 p.m.
- Last updated at: Sept. 4, 2022, 2:36 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 42
- Number of elements: 6
- Element list: ['Ba', 'Y', 'Si', 'B', 'O', 'F']
- Chemical System: B-Ba-F-O-Si-Y
- Density: 4.4383352638923865
- Atomic Density: 0.09039516646874288
- Unit Cell Volume: 464.6266126908776
- Molar Volume: 6.662016339205875
- Full Formula: Ba1 Y6 Si3 B6 O24 F2
- Reduced Formula: BaY6Si3B6(O12F)2
- Formula Anonymous: AB2C3D6E6F24
- Spacegroup Number: 156
- Spacegroup Symbol: P3m1
- Crystal System: trigonal
- Pointgroup: 3m1
