The Journal of chemical physics
Hierarchical dynamics of hydronium ions in polymer electrolyte membranes revealed by all-atom molecular dynamics simulations.
Taketoshi Kitagawa, Yusuke Yasuda, Tetsuro Nagai, Kazushi Fujimoto
Published: 202510.1063/5.0293744
Abstract
Understanding the transport dynamics of hydronium ions (H3O+) in polymer electrolyte membranes is critical for improving the performance of polymer electrolyte fuel cells. In this study, we performed all-atom molecular dynamics simulations of hydrate…
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