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Resonance Raman and temperature-dependent electronic absorption spectra of cavity and noncavity models of the hydrated electron

Most of what is known about the structure of the hydrated electron comes from mixed quantum/classical simulations, which depend on the pseudopotential that couples the quantum electron to the classical water molecules. These potentials usually are highly repulsive, producing cavity-bound hydrated el...

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Autori principali: Casey, Jennifer R., Larsen, Ross E., Schwartz, Benjamin J.
Natura: Artigo
Lingua:Inglês
Pubblicazione: National Academy of Sciences 2013
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC3581931/
https://ncbi.nlm.nih.gov/pubmed/23382233
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1219438110
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