“…Hence, the defect-dependent structural, physical, and chemical properties can be exploited for various applications, e.g., electrocatalytic hydrogen evolution, gas sensors, spintronics, multiferroics, memristive devices, etc. [24][25][26][27][28][29][30][31][32][33][34][35][36] For 2D elemental materials (e.g., phosphorene, graphene, and silicene) with honeycomb-like structures, known point defects include the Stone-Wales (SW), single vacancy (SV), and double vacancy (DV) defects, which have been exten-sively investigated. 24,25,[37][38][39][40] Among them, the SW defect has been viewed as the most popular defect in 2D elemental sheets because it generally entails the lowest formation energy (E f ).…”