“…2,3 Due to its high electron mobility (B2.70 cm s À1 ), high thermal resistance, high radiation resistance, and good chemical stability, GaN has been widely used in optoelectronic devices, high-temperature highpower devices, and high-frequency microwave devices. [4][5][6][7][8][9][10][11][12][13] Heterojunctions between semiconductors and metals are frequently widely used in electron devices, 14 and there have been many studies on heterojunctions between GaN and transition metals (TMs) both experimentally and theoretically, such as Ag, 15 Au, 15 Pb, 16 Pt, 17 Pd, 17 Fe, 18 Co, [18][19][20] and Ni. 21 Importantly, the atomic structures and structural defects of the metal/ semiconductor interfaces would directly affect the physical, chemical, and electronic properties of the devices.…”