Original paper

Ab Initio Investigation of the Resonance Raman Spectrum of the Hydrated Electron

Volume: 123, Issue: 38, Pages: 8074 - 8085
Published: Aug 23, 2019
Abstract
According to the conventional picture, the aqueous or "hydrated" electron, e-(aq), occupies an excluded volume (cavity) in the structure of liquid water. However, simulations with certain one-electron models predict a more delocalized spin density for the unpaired electron, with no distinct cavity structure. It has been suggested that only the latter (non-cavity) structure can explain the hydrated electron's resonance Raman spectrum, although...
Paper Details
Title
Ab Initio Investigation of the Resonance Raman Spectrum of the Hydrated Electron
Published Date
Aug 23, 2019
Volume
123
Issue
38
Pages
8074 - 8085
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