Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-687446
- Created at: Sept. 4, 2022, 3:52 p.m.
- Last updated at: Sept. 4, 2022, 3:52 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 92
- Number of elements: 4
- Element list: ['Br', 'C', 'H', 'N']
- Chemical System: Br-C-H-N
- Density: 1.6096544158068717
- Atomic Density: 0.11369953372991504
- Unit Cell Volume: 809.1501959765227
- Molar Volume: 5.296539539295876
- Full Formula: H56 C20 Br4 N12
- Reduced Formula: H14C5BrN3
- Formula Anonymous: AB3C5D14
- Spacegroup Number: 14
- Spacegroup Symbol: P12_1/c1
- Crystal System: monoclinic
- Pointgroup: 2/m
