Interlayer distances, lattice mismatches and global band gaps (without and with SOC) of the decorated monolayers on the SiC substrate.
| Material | Lattice mismatch (%) | Interlayer distance (Å) | E g without SOC (eV) | E g with SOC (eV) |
|---|---|---|---|---|
| PbNH2 on SiC | 4.468 | 2.4668 | 0.382 | 0.811 |
| PbOH on SiC | 1.879 | 1.4824 | 0.438 | 1.010 |
| PbSH on SiC | 3.542 | 2.2360 | 0.511 | 0.866 |