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Slow hydrogen-bond switching dynamics at the water surface revealed by theoretical two-dimensional sum-frequency spectroscopy

Using our newly developed explicit three-body (E3B) water model, we simulate the surface of liquid water. We find that the timescale for hydrogen-bond switching dynamics at the surface is about three times slower than that in the bulk. In contrast, with this model rotational dynamics are slightly fa...

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Detalhes bibliográficos
Main Authors: Ni, Yicun, Gruenbaum, Scott M., Skinner, James L.
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 2013
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3568345/
https://ncbi.nlm.nih.gov/pubmed/23329327
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1222017110
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