Diffusion enhancement in core-softened fluid confined in nanotubes

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Diffusion enhancement in core-softened fluid confined in nanotubes.

We study the effect of confinement in the dynamical behavior of a core-softened fluid. The fluid is modeled as a two length scales potential. This potential in the bulk reproduces the anomalous behavior observed in the density and in the diffusion of liquid water. A series of NpT molecular dynamics simulations for this two length scales fluid confined in a nanotube were performed. We obtain tha...

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ژورنال

عنوان ژورنال: The Journal of Chemical Physics

سال: 2012

ISSN: 0021-9606,1089-7690

DOI: 10.1063/1.4746748