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• W2015127837 abstract "The local vibrational modes (LVM's) of the oxygen chains assigned to thermal double donors (TDD's) and other related oxygen defects in silicon are studied using accurate total-energy calculations. We find that the calculated LVM frequencies as well as their isotopic shifts and charge-state dependences (temperature dependences) for the oxygen chains agree closely with the corresponding experimental quantities, which supports our assignments of the ${mathrm{O}}_{2i}ensuremath{-}{mathrm{O}}_{2r}$ chain to TDD1 and the ${mathrm{O}}_{i}ensuremath{-}{mathrm{O}}_{mathrm{nr}}ensuremath{-}{mathrm{O}}_{i}$ chains to $mathrm{TDD}n$ $(n>1)$ $({mathrm{O}}_{i}$ is an interstitial oxygen and ${mathrm{O}}_{r}$ a threefold coordinated oxygen belonging to a ring)." @default.
• W2015127837 created "2016-06-24" @default.
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• W2015127837 date "2002-08-30" @default.
• W2015127837 modified "2023-09-25" @default.
• W2015127837 title "Local vibrations of thermal double donors in silicon" @default.
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• W2015127837 doi "https://doi.org/10.1103/physrevb.66.075219" @default.
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