“…Altering the surface-rich structure and atomic arrangements of two-dimensional (2D) materials has led to the emergence of new promising functionalities of semiconductors, 1,2 providing exciting opportunities for catalysis, energy conversion and storage, electronics, and sensing. [3][4][5] Variations in mechanical, electronic, and chemical properties have been reported by the introduction of folds, pores, Moiré stacks, or more localized defects in the layers. 6,7 Deep changes in the electronic structure of 2D materials, including the creation of new states in the bandgap of semiconducting 2D systems, have been predicted by first-principles calculations and confirmed experimentally, such as for selected nanoscale defects introduced in hexagonal boron nitride (h-BN).…”