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arxiv: cond-mat/0104317 · v1 · submitted 2001-04-18 · ❄️ cond-mat.stat-mech · cond-mat.soft

On the mean field treatment of attractive interactions in nonuniform simple fluids

classification ❄️ cond-mat.stat-mech cond-mat.soft
keywords fieldveryradiisoluteariseattractiveeffectiveinteractions
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We study thermodynamic and structural properties of a Lennard-Jones liquid at a state very close to the triple point as the radius of a hard sphere solute is varied. Oscillatory profiles arise for small, molecular sized radii while for large radii smooth interfaces with a ``drying layer'' of low vapor density near the solute are seen. We develop a quantitative theory for this process using a new mean field treatment where the effects of attractive interactions are described in terms of a self-consistently chosen effective single particle field. We modify the usual simple molecular field approximation for the effective field in a very natural way so that exact results (consistent with a given accurate equation of state for the uniform fluid) arise in the ``hydrostatic limit'' of very slowly varying interfaces. Very good agreement with the results of computer simulations for a wide range of solute radii are found.

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