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arxiv: 0705.4168 · v1 · submitted 2007-05-29 · ❄️ cond-mat.soft

Selective-pivot sampling of radial distribution functions in asymmetric liquid mixtures

classification ❄️ cond-mat.soft
keywords distributionmixturesradialalgorithmasymmetricfunctionshard-sphereinteraction
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We present a Monte Carlo algorithm for selectively sampling radial distribution functions and effective interaction potentials in asymmetric liquid mixtures. We demonstrate its efficiency for hard-sphere mixtures, and for model systems with more general interactions, and compare our simulations with several analytical approximations. For interaction potentials containing a hard-sphere contribution, the algorithm yields the contact value of the radial distribution function.

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