Comment on "Does the hydrated electron occupy a cavity?".
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Liquid-state polaron theory of the hydrated electron revisited.Resonance Raman and temperature-dependent electronic absorption spectra of cavity and noncavity models of the hydrated electronTemperature dependence of the hydrated electron's excited-state relaxation. II. Elucidating the relaxation mechanism through ultrafast transient absorption and stimulated emission spectroscopy.Temperature dependence of the hydrated electron's excited-state relaxation. I. Simulation predictions of resonance Raman and pump-probe transient absorption spectra of cavity and non-cavity models.Gamma and Ion-Beam Irradiation of DNA: Free Radical Mechanisms, Electron Effects, and Radiation Chemical Track Structure.Ab initio molecular dynamics simulations reveal localization and time evolution dynamics of an excess electron in heterogeneous CO2-H2O systems.A Simple ab Initio Model for the Hydrated Electron That Matches Experiment.Real-time observation of the charge transfer to solvent dynamics.Thermal effects on energetics and dynamics in water cluster anions (H2O)n(-).Counterintuitive electron localisation from density-functional theory with polarisable solvent models.Extreme density-driven delocalization error for a model solvated-electron system.Benchmark calculations of excess electrons in water cluster cavities: balancing the addition of atom-centered diffuse functions versus floating diffuse functions.On the applicability of one- and many-electron quantum chemistry models for hydrated electron clusters.
P2860
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P2860
Comment on "Does the hydrated electron occupy a cavity?".
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2011 nî lūn-bûn
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2011年の論文
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2011年学术文章
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2011年学术文章
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2011年学术文章
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Comment on "Does the hydrated electron occupy a cavity?".
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Comment on "Does the hydrated electron occupy a cavity?".
@nl
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Comment on "Does the hydrated electron occupy a cavity?".
@en
Comment on "Does the hydrated electron occupy a cavity?".
@nl
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Comment on "Does the hydrated electron occupy a cavity?".
@en
Comment on "Does the hydrated electron occupy a cavity?".
@nl
P2860
P356
P1433
P1476
Comment on "Does the hydrated electron occupy a cavity?".
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P2093
Leif D Jacobson
P2860
P304
1387; author reply 1387
P356
10.1126/SCIENCE.1198191
P407
P577
2011-03-01T00:00:00Z