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• W2564309622 abstract "A hydrogen-related defect in ZnO which causes two broad IR absorption bands at 3303 and $3321 {mathrm{cm}}^{ensuremath{-}1}$ is studied by means of infrared absorption spectroscopy and first-principles theory. In deuterated samples, the defect reveals two sharp absorption lines at 2466 and $2488 {mathrm{cm}}^{ensuremath{-}1}$ accompanied by weaker sidebands at 2462 and $2480 {mathrm{cm}}^{ensuremath{-}1}$. Isotope substitution experiments with varying concentrations of H and D together with polarization-sensitive measurements strongly suggest that these IR absorption lines are due to stretch local vibrational modes of a defect comprising three equivalent hydrogen atoms. The zinc vacancy decorated by three hydrogen atoms, ${V}_{mathrm{Zn}}{mathrm{H}}_{3}$, and ammonia trapped at the zinc vacancy, $({mathrm{NH}}_{3}){}_{mathrm{Zn}}$, are discussed as a possible origin for the complex." @default.
• W2564309622 created "2017-01-06" @default.
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• W2564309622 date "2015-10-09" @default.
• W2564309622 modified "2023-10-15" @default.
• W2564309622 title "Infrared absorption on a complex comprising three equivalent hydrogen atoms in ZnO" @default.
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• W2564309622 doi "https://doi.org/10.1103/physrevb.92.155203" @default.
• W2564309622 hasPublicationYear "2015" @default.
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