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We have used first-principles calculations, based on advanced hybrid density functional theory, to accurately model diffusion of point defects and impurities in Ga2O3. Control of doping is crucial for devices: it should be possible to control the carrier concentrations all the way from semi-insulating to highly conductive n-type material. I will discuss impurities used for donor doping, deep acceptors, as well as unintentional contaminants such as carbon and hydrogen. The results provide important guidance for incorporating Ga2O3 into devices.
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Mengen Wang, Sai Mu, Chris Van de Walle, "First-principles studies of diffusion in gallium oxide," Proc. SPIE 12002, Oxide-based Materials and Devices XIII, 120020B (5 March 2022); https://doi.org/10.1117/12.2618021