23 citations · 34 across the 2 of their papers we have counts for
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physics.app-ph2020★ 11 cited
Ion transport across solid-state ion channels perturbed by directed strain
A. Smolyanitsky, A. Fang, A. F. Kazakov +1
We combine quantum-chemical calculations and molecular dynamics simulations to consider aqueous ion flow across non-axisymmetric nanopores in monolayer graphene and MoS. When t…
physics.app-ph2018
Mechanosensitive ion permeation across sub-nanoporous MoS monolayers
A. Fang, K. Kroenlein, A. Smolyanitsky
We use all-atom molecular dynamics simulations informed by density functional theory calculations to investigate aqueous ion transport across sub-nanoporous monolayer molybdenum di…
physics.app-ph2018
Aqueous ion trapping and transport in graphene-embedded 18-crown-6 ether pores
A. Smolyanitsky, E. Paulechka, K. Kroenlein
Using extensive room-temperature molecular dynamics simulations, we investigate selective aqueous cation trapping and permeation in graphene-embedded 18-crown-6 ether pores. We sho…