Physics – Condensed Matter – Soft Condensed Matter
Scientific paper
2002-05-22
Physics
Condensed Matter
Soft Condensed Matter
4 pages, 4 figures
Scientific paper
10.1103/PhysRevLett.89.175502
Molecular Dynamics simulations of water molecules in nanometre sized cylindrical channels connecting two reservoirs show that the permeation of water is very sensitive to the channel radius and to electric polarization of the embedding material. At threshold, the permeation is {\emph{intermittent}} on a nanosecond timescale, and strongly enhanced by the presence of an ion inside the channel, providing a possible mechanism for gating. Confined water remains surprisingly fluid and bulk-like. Its behaviour differs strikingly from that of a reference Lennard-Jones fluid, which tends to contract into a highly layered structure inside the channel.
Allen Rosalind
Hansen Jean-Pierre
Melchionna Simone
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