84 citations
- University of ChicagoUS14 papers
- Argonne National LaboratoryUS3 papers
- Columbia UniversityUS3 papers
- University of Illinois Urbana-ChampaignUS3 papers
- Stanford UniversityUS2 papers
- Barcelona Supercomputing CenterES1 paper
- Biologie Moléculaire Structurale et Processus InfectieuxFR1 paper
- Budapest University of Technology and EconomicsHU1 paper
- Center for Theoretical Biological PhysicsUS1 paper
- Centre National de la Recherche ScientifiqueFR1 paper
- City University of New YorkUS1 paper
- Cleveland Clinic Lerner College of MedicineUS1 paper
Showing 2020Show all
2 papers · 1 filter
physics.chem-ph2020★ 30 cited
The Hopping Mechanism of the Hydrated Excess Proton and Its Contribution to Proton Diffusion in Water
Christopher Arnsten, Chen Chen, Paul B. Calio +2
In this work a series of analyses are performed on ab initio molecular dynamics (AIMD) simulations of a hydrated excess proton in water to quantify the relative occurrence of conce…
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…