Interactions between the Aryldiazonium Cations and Graphene Oxide: A DFT Study

Figure 3

(a) Grafting positions (G1–G3) and (b) computed BDEs in vacuum and water (COSMO) for the bonding of phenyl radicals and nitrophenyl radicals at 3 distinctive grafting positions onto the GOx surface.

(a)

(b)