most citedA quantum mechanical insight into SN2 reactions: Semiclassical initial value representation calculations of vibrational features of the Cl--CHCl pre-reaction complex with the VENUS suite of codes

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cond-mat.soft2020

Water Assisted Proton Transport in Confined Nanochannels

Xinyou Ma, Chenghan Li, Alex B. F. Martinson +1

Hydrated excess protons under hydrophobic confinement are a critical component of charge transport behavior and reactivity in nanoporous materials and biomolecular systems. Herein…