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- W2054724043 abstract "The effect of the Coulomb correlations in diluted magnetic III-V semiconductors has been evaluated using the $mathrm{LSDA}+mathrm{U}$ (LSDA, local spin-density approximation) correlated band theory method. We show that Coulomb U plays an important role in determination of d-Mn states' interaction with the semiconductor host valence band. For ${mathrm{Ga}}_{1ensuremath{-}x}{mathrm{Mn}}_{x}mathrm{As},$ we found a reasonable value of d-Mn binding energy, in agreement with the experiment. For ${mathrm{Ga}}_{1ensuremath{-}x}{mathrm{Mn}}_{x}mathrm{N}$ alloy, an account of the Coulomb U turns to be even more important, removing sharp d peak from the top of the valence band, while no significant modification of Mn impurity level in the band gap is found." @default.
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- W2054724043 date "2004-03-15" @default.
- W2054724043 modified "2023-09-26" @default.
- W2054724043 title "Coulomb correlation effects on the electronic structure of III-V diluted magnetic semiconductors" @default.
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- W2054724043 doi "https://doi.org/10.1103/physrevb.69.125207" @default.
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