23 citations · 34 across the 2 of their papers we have counts for
6 papers
Nanopores in atomically thin 2D nanosheets limit aqueous ssDNA transport
Alex Smolyanitsky, Binquan Luan
Nanopores in 2D materials are highly desirable for DNA sequencing, yet achieving single-stranded DNA (ssDNA) transport through them is challenging. Using density functional theory…
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…
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…
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…
Graphene deflectometry for sensing molecular processes at the nanoscale
Daniel Gruss, Alex Smolyanitsky, Michael Zwolak
Single-molecule sensing is at the core of modern biophysics and nanoscale science, from revolutionizing healthcare through rapid, low-cost sequencing to understanding various physi…
Relaxation-limited electronic currents in extended reservoir simulations
Daniel Gruss, Alex Smolyanitsky, Michael Zwolak
Open-system approaches are gaining traction in the simulation of charge transport in nanoscale and molecular electronic devices. In particular, "extended reservoir" simulations, wh…