Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-97956
- 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: 84
- Number of elements: 5
- Element list: ['B', 'H', 'C', 'N', 'O']
- Chemical System: B-C-H-N-O
- Density: 1.5978148833664698
- Atomic Density: 0.12401083131699232
- Unit Cell Volume: 677.3601878797347
- Molar Volume: 4.856140948371199
- Full Formula: B4 H40 C8 N20 O12
- Reduced Formula: BH10C2N5O3
- Formula Anonymous: AB2C3D5E10
- Spacegroup Number: 19
- Spacegroup Symbol: P2_12_121
- Crystal System: orthorhombic
- Pointgroup: 222
