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- W2425508638 abstract "${mathrm{H}}^{+}ensuremath{-}{mathrm{H}}_{2}mathrm{O}$ collisions are investigated using the time-dependent density-functional theory combined with the molecular dynamics method, in which the electrons are described quantum mechanically within the framework of time-dependent density-functional theory and the ionic cores are described classically by Newton's equations. The feedback between quantum electrons and classical ions is self-consistently coupled by Ehrenfest's method. The electron capture, electron loss, and ionization cross sections are obtained in the energy range of 1--1000 keV and excellent agreements are achieved with available experimental and theoretical data. The orientation effects of the ${mathrm{H}}_{2}mathrm{O}$ target are found to be significant in the collision processes, especially in low-energy collisions." @default.
- W2425508638 created "2016-06-24" @default.
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- W2425508638 date "2016-06-15" @default.
- W2425508638 modified "2023-10-16" @default.
- W2425508638 title "<mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant=normal>H</mml:mi></mml:mrow><mml:mo>+</mml:mo></mml:msup><mml:mo>−</mml:mo><mml:msub><mml:mi mathvariant=normal>H</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:mi mathvariant=normal>O</mml:mi></mml:mrow></mml:math>collisions studied by time-dependent density-functional theory combined with the molecular dynamics method" @default.
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- W2425508638 doi "https://doi.org/10.1103/physreva.93.062706" @default.
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