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cond-mat.stat-mech2025
Secondary finite-size effects and multi-barrier free energy landscapes in molecular simulations of hindered ion transport
Omar Khalifa, Brian A. Shoemaker, Amir Haji-Akbari
Ion transport through nanoscale channels and pores is pivotal to numerous natural processes and industrial applications. Experimental investigation of the kinetics and mechanisms o…
cond-mat.stat-mech2022★ 9 cited
Ideal Conductor Model: An analytical finite-size correction for non-equilibrium molecular dynamics simulations of ion transport through nanoporous membranes
Brian A Shoemaker, Tiago S Domingues, Amir Haji-Akbari
Modulating ion transport through nanoporous membranes is critical to many important chemical and biological separation processes. The corresponding transport timescales, however, a…