Effect of Isovalent Doping on Hydrogen Passivated Vacancy-oxygen Defect Complexes in Silicon: Insights from Density Functional Theory
Sign Up to like & getrecommendations! Published in 2020 at "Silicon"
DOI: 10.1007/s12633-020-00548-5
Abstract: Using the hybrid density functional theory (DFT) computational approach, we examine the effect of hydrogen passivation and isovalent doping on the vacancy(V n )-oxygen interstitial(O i ), i.e., V n -O m i ( n… read more here.
Keywords: hydrogen; effect; defect complexes; defect ... See more keywords
Ab initio study of N-doped β-Ga2O3 with intrinsic defects: the structural, electronic and optical properties
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Alloys and Compounds"
DOI: 10.1016/j.jallcom.2017.04.020
Abstract: Abstract We investigated the compensation mechanism between N acceptors and native defects in β-Ga 2 O 3 by employing the approach of pseudopotential plane-wave under the density functional theory framework. Four types of defect complexes:… read more here.
Keywords: ga2o3; intrinsic defects; optical properties; ga2o3 doped ... See more keywords