Molecular Dynamics Simulation of Tolman Length and Interfacial Tension of Symmetric Binary Lennard–Jones Liquid

نویسندگان

چکیده

The Tolman length and interfacial tension of partially miscible symmetric binary Lennard–Jones (LJ) fluids (A, B) was revealed by performing a large-scale molecular dynamics (MD) simulation with sufficient area cutting distance. A unique phenomenon observed in LJ fluids, where two surfaces existed on both sides an equimolar dividing surface. range interaction εAB between the different liquids temperature which mixed clarified, exceeded 3 σ when strong at higher temperatures. results show that as or increases, increases decreases. This very long indicates one should be careful applying concept liquid–liquid interface usual continuum approximation to nanoscale droplets capillary phase separation nanopores.

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ژورنال

عنوان ژورنال: Symmetry

سال: 2021

ISSN: ['0865-4824', '2226-1877']

DOI: https://doi.org/10.3390/sym13081376