Proton Dynamics at the Water–Silica Interface via Dissociative Molecular Dynamics
Author:
Affiliation:
1. Interfacial Molecular Science Laboratory, Department of Materials Science and Engineering, Rutgers University, 607 Taylor Road, Piscataway, New Jersey 08855, United States
Publisher
American Chemical Society (ACS)
Subject
Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials
Link
https://pubs.acs.org/doi/pdf/10.1021/jp507640y
Reference57 articles.
1. Ab Initio Molecular Dynamics Simulation of the Solvation and Transport of H3O+ and OH- Ions in Water
2. Special Pair Dance and Partner Selection: Elementary Steps in Proton Transport in Liquid Water
3. An Improved Multistate Empirical Valence Bond Model for Aqueous Proton Solvation and Transport
4. Kinetics of Proton Migration in Liquid Water
5. Ultrafast Vibrational and Structural Dynamics of the Proton in Liquid Water
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