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• W2045017079 endingPage "8186" @default.
• W2045017079 startingPage "8180" @default.
• W2045017079 abstract "In the last years, complexes formed by atomic H and gallium vacancies ${(V}_{mathrm{Ga}})$ have been investigated in order to account for donor-acceptor bands observed in the photoluminescence spectra of hydrogenated GaAs. New configurations for these complexes are investigated here, together with the kinetic properties of the H donors that affect the complex stability critically. In addition to the H donor, a peculiar ${V}_{mathrm{Ga}}ensuremath{-}mathrm{H}$ complex has been shown to behave as a donor. The electronic levels in the energy gap and several H vibrational modes have been studied for the new and the old configurations of the $mathrm{H}ensuremath{-}{V}_{mathrm{Ga}}$ complexes, as well as for the new donor. The new complexes are more stable than those previously studied and can well account for the photoluminescence results. The values of the H vibrational frequencies are quite different for the different types of complexes, which should permit a determination of the microstructure of the $mathrm{H}ensuremath{-}{V}_{mathrm{Ga}}$ complexes by infrared spectroscopy." @default.
• W2045017079 created "2016-06-24" @default.
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• W2045017079 date "2000-03-15" @default.
• W2045017079 modified "2023-09-26" @default.
• W2045017079 title "Structure, kinetics, and vibrational properties of complexes formed by hydrogen and gallium vacancies in GaAs: A theoretical study" @default.
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• W2045017079 doi "https://doi.org/10.1103/physrevb.61.8180" @default.
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