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Published on: September 13, 2011
Using the second virial coefficient as physical criterion to map the hard-sphere potential onto a continuous
César Alejandro Báez1, Alexis Torres-Carbajal1, Ramón Castañeda-Priego1
1División de Ciencias e Ingenierías, Campus León, Universidad de Guanajuato, Loma del Bosque 103, Colonia Lomas del Campestre, 37150 León, Guanajuato, Mexico.
Abstract:
In the same sense as in the extended law of corresponding states [M. Noro and D. Frenkel, J. Chem. Phys. 113, 2941 (2000)], we propose the use of the second virial coefficient to map the hard-sphere potential onto a continuous potential. We show that this criterion provides accurate results when the continuous potential is used, for example, in computer simulations to reproduce the physical properties of systems with hard-core interactions. We also demonstrate that this route is straightforwardly applicable to any spatial dimension, does not depend on the particle density and, from a numerical point of view, is easy to implement.
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