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arxiv: 1201.2771 · v2 · pith:BN7RP4VHnew · submitted 2012-01-13 · ❄️ cond-mat.soft · cond-mat.stat-mech· physics.chem-ph

Rational-function approximation for fluids interacting via piece-wise constant potentials

classification ❄️ cond-mat.soft cond-mat.stat-mechphysics.chem-ph
keywords approximationconstantfluidspiece-wisepluspotentialpotentialsrational-function
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The structural properties of fluids whose molecules interact via potentials with a hard-core plus n piece-wise constant sections of different widths and heights are derived using a (semi-analytical) rational-function approximation method. The results are illustrated for the cases of a square-shoulder plus square-well potential and a shifted square-well potential and compared both with simulation data and with those that follow from the (numerical) solutions of the Percus-Yevick integral equation.

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