Coarse-graining intermolecular interactions in dispersions of highly charged colloids |
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Authors: | Turesson Martin Jönsson Bo Labbez Christophe |
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Institution: | ICB, UMR 6303 CNRS, Université de Bourgogne, Dijon, France. martin.turesson@u-bourgogne.fr |
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Abstract: | Effective pair potentials between charged colloids, obtained from Monte Carlo simulations of two single colloids in a closed cell at the primitive model level, are shown to reproduce accurately the structure of aqueous salt-free colloidal dispersions, as determined from full primitive model simulations by Linse et al. (Linse, P.; Lobaskin, V. Electrostatic Attraction and Phase Separation in Solutions of Like-Charged Colloidal Particles. Phys. Rev. Lett.1999, 83, 4208). Excellent agreement is obtained even when ion-ion correlations are important and is in principle not limited to spherical particles, providing a potential route to coarse-grained colloidal interactions in more complex systems. |
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