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• W2016226225 abstract "The electronic structure and the nature of optical transitions in oxygen dangling bond in silica glass, the nonbridging oxygen hole center (NBOHC), were calculated. The calculation reproduced well the peak positions and oscillator strengths of the well-known optical absorption bands at 2.0 and 4.8 eV, and of the recently discovered absorption band at 6.8 eV. The 2.0 eV band was attributed to transition from the sigma bond between Si and dangling oxygen to nonbonding pi orbital on the dangling oxygen. The uniquely small electron-phonon coupling associated with the 2.0 eV transition is explained by stabilization of Si-O bond in the excited state by hyperconjugation effects." @default.
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• W2016226225 date "2003-05-08" @default.
• W2016226225 modified "2023-09-23" @default.
• W2016226225 title "Electronic Structure of Oxygen Dangling Bond in Glassy<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML display=inline><mml:msub><mml:mrow><mml:mi mathvariant=normal>S</mml:mi><mml:mi mathvariant=normal>i</mml:mi><mml:mi mathvariant=normal>O</mml:mi></mml:mrow><mml:mn>2</mml:mn></mml:msub></mml:math>: The Role of Hyperconjugation" @default.
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• W2016226225 doi "https://doi.org/10.1103/physrevlett.90.186404" @default.
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