“…Therefore, in recent years, several efforts have been made to functionalize the h‐BN monolayer, which can massively expand its area of applications. Indeed, the electronic structure and properties of h‐BN nanomaterials can be effectively tuned through chemical doping and modification, [27] specifically, the introduction of dopants such as carbon, [17,18,27–29] oxygen, [10,17,27,28,30,31] and even metal atoms [32] in h‐ BN has been achieved in experiments and mostly applied into the photo‐ and electro‐ catalytic field. Beyond the heteroatom doping, the antisite defects (B replacing N, or N replacing B) are probably active centers for catalytic reactions.…”