471 research outputs found

    Simple equation of state for hard disks on the hyperbolic plane

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    A simple equation of state for hard disks on the hyperbolic plane is proposed. It yields the exact second virial coefficient and contains a pole at the highest possible packing. A comparison with another very recent theoretical proposal and simulation data is presented.Comment: 3 pages, 1 figur

    Demixing can occur in binary hard-sphere mixtures with negative non-additivity

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    A binary fluid mixture of non-additive hard spheres characterized by a size ratio γ=σ2/σ1<1\gamma=\sigma_2/\sigma_1<1 and a non-additivity parameter Δ=2σ12/(σ1+σ2)1\Delta=2\sigma_{12}/(\sigma_1+\sigma_2)-1 is considered in infinitely many dimensions. From the equation of state in the second virial approximation (which is exact in the limit dd\to\infty) a demixing transition with a critical consolute point at a packing fraction scaling as ηd2d\eta\sim d 2^{-d} is found, even for slightly negative non-additivity, if Δ>1/8(lnγ)2\Delta>-{1/8}(\ln\gamma)^2. Arguments concerning the stability of the demixing with respect to freezing are provided.Comment: 4 pages, 2 figures; title changed; final paragraph added; to be published in PRE as a Rapid Communicatio

    On the liquid-glass transition line in monatomic Lennard-Jones fluids

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    A thermodynamic approach to derive the liquid-glass transition line in the reduced temperature vs reduced density plane for a monatomic Lennard-Jones fluid is presented. The approach makes use of a recent reformulation of the classical perturbation theory of liquids [M. Robles and M. L\'opez de Haro, Phys. Chem. Chem. Phys. {\bf 3}, 5528 (2001)] which is at grips with a rational function approximation for the Laplace transform of the radial distribution function of the hard-sphere fluid. The only input required is an equation of state for the hard-sphere system. Within the Mansoori-Canfield/Rasaiah-Stell variational perturbation theory, two choices for such an equation of state, leading to a glass transition for the hard-sphere fluid, are considered. Good agreement with the liquid-glass transition line derived from recent molecular dynamic simulations [Di Leonardo et al., Phys. Rev. Lett. {\bf 84}, 6054(2000)] is obtained.Comment: 4 pages, 2 figure

    Multicomponent fluids of hard hyperspheres in odd dimensions

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    Mixtures of hard hyperspheres in odd space dimensionalities are studied with an analytical approximation method. This technique is based on the so-called Rational Function Approximation and provides a procedure for evaluating equations of state, structure factors, radial distribution functions, and direct correlations functions of additive mixtures of hard hyperspheres with any number of components and in arbitrary odd-dimension space. The method gives the exact solution of the Ornstein--Zernike equation coupled with the Percus--Yevick closure, thus extending to arbitrary odd dimension the solution for hard-sphere mixtures [J. L. Lebowitz, Phys.\ Rev.\ \textbf{133}, 895 (1964)]. Explicit evaluations for binary mixtures in five dimensions are performed. The results are compared with computer simulations and a good agreement is found.Comment: 16 pages, 8 figures; v2: slight change of notatio

    Structural properties of fluids interacting via piece-wise constant potentials with a hard core

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    The structural properties of fluids whose molecules interact via potentials with a hard core plus two piece-wise constant sections of different widths and heights are presented. These follow from the more general development previously introduced for potentials with a hard core plus nn piece-wise constant sections [Condens. Matter Phys. {\bf 15}, 23602 (2012)] in which use was made of a semi-analytic rational-function approximation method. The results of illustrative cases comprising eight different combinations of wells and shoulders are compared both with simulation data and with those that follow from the numerical solution of the Percus-Yevick and hypernetted-chain integral equations. It is found that the rational-function approximation generally predicts a more accurate radial distribution function than the Percus-Yevick theory and is comparable or even superior to the hypernetted-chain theory. This superiority over both integral equation theories is lost, however, at high densities, especially as the widths of the wells and/or the barriers increase.Comment: 10 pages, 11 figures; v2: Old Fig. 1 removed, new text on the correlation length, 7 new references added, plus other minor change

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

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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.Comment: 12 pages, 2 figures; submitted to a special issue of Condensed Matter Physics in occasion of the 60th birthday of Prof. Orest Pizi
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