| hfcc | Hyperfine Coupling Constant |
| DFT | Density Functional Theory |
| B3LYP | Becke, Lee–Yang–Parr |
| TPSSh | Tao, Perdew, Staroverov, Scuseria, hybrid |
| PBE0 | Perdew, Burke and Ernzerhof |
| hfcc | Hyperfine Coupling Constant |
| DFT | Density Functional Theory |
| B3LYP | Becke, Lee–Yang–Parr |
| TPSSh | Tao, Perdew, Staroverov, Scuseria, hybrid |
| PBE0 | Perdew, Burke and Ernzerhof |