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Ab Initio Investigation on Intrinsic Ga Vacancies in Β-Ga2o3 Utilizing Hybrid Functional Combined with the Shell DFT-1/2 Approach

L.Y. Hao, X.P. Zhang, M.Y. Niu, S.K. Shen, X. Liu, S.L. Zhang, J.L. Du, P.P. Wang, P. Liu,E.G. Fu

Computational Materials Science(2025)

Cited 0|Views1
Key words
shell DFT-1/2,β-Ga2O3,Ga vacancy,Electronic structures,Optical properties
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