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Related papers: Pair correlation function of short-ranged square-w…

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We use the extension of scaled particle theory (ESPT) presented in the accompanying paper [Stillinger et al. J. Chem. Phys. xxx, xxx (2007)] to calculate numerically pair correlation function of the hard sphere fluid over the density range…

Statistical Mechanics · Physics 2009-11-11 Swaroop Chatterjee , Pablo G. Debenedetti , Frank H. Stillinger

Bounded potentials are good models to represent the effective two-body interaction in some colloidal systems, such as dilute solutions of polymer chains in good solvents. The simplest bounded potential is that of penetrable spheres, which…

Statistical Mechanics · Physics 2007-05-23 Alexandr Malijevsky , Andres Santos

We study structural and thermophysical properties of a one-dimensional classical fluid made of penetrable spheres interacting via an attractive square-well potential. Penetrability of the spheres is enforced by reducing from infinite to…

Soft Condensed Matter · Physics 2009-09-24 Riccardo Fantoni , Achille Giacometti , Alexandr Malijevský , Andrés Santos

We have obtained by Monte Carlo NVT simulations the constant-volume excess heat capacity of square-well fluids for several temperatures, densities and potential widths. Heat capacity is a thermodynamic property much more sensitive to the…

Statistical Mechanics · Physics 2007-05-23 J. Largo , J. R. Solana , L. Acedo , A. Santos

The aim of this work is to investigate to what extent the structural properties of a short-range square-well (SW) fluid of range $\lambda$ at a given packing fraction and reduced temperature can be represented by those of a…

Statistical Mechanics · Physics 2007-05-23 Alexandr Malijevsky , Santos B. Yuste , Andres Santos

The two-body interaction in dilute solutions of polymer chains in good solvents can be modeled by means of effective bounded potentials, the simplest of which being that of penetrable spheres (PSs). In this paper we construct two simple…

Soft Condensed Matter · Physics 2007-08-19 Alexandr Malijevsky , Santos B. Yuste , Andres Santos

A comparison of simulation results with the prediction of the structural properties of square-shoulder fluids is carried out to assess the performance of three theories: Tang--Lu's first-order mean spherical approximation, the simplified…

Soft Condensed Matter · Physics 2016-03-01 M. López de Haro , S. B. Yuste , A. Santos

We perform Monte Carlo simulation of the thermodynamic and structural properties of Hard-, Square-Well, and Square-Shoulder Disks in narrow channels. For the thermodynamics we study the internal energy per particle and the longitudinal and…

Statistical Mechanics · Physics 2024-04-15 Riccardo Fantoni

In this work we extend the applicability of the microcanonical ensemble simulation method, originally proposed to study the Ising model (A. H\"uller and M. Pleimling, Int. Journal of Modern Physics C, 13, 947 (2002),…

Statistical Mechanics · Physics 2015-09-16 Francisco Sastre , Ana Laura Benavides , José Torres-Arenas , Alejandro Gil-Villegas

The rational function approximation method, density functional theory, and NVT Monte Carlo simulation are used to obtain the density profiles of multicomponent hard-sphere mixtures near a planar hard wall. Binary mixtures with a size ratio…

Statistical Mechanics · Physics 2007-06-06 Alexandr Malijevsky , Santos B. Yuste , Andres Santos , Mariano Lopez de Haro

Continuing our investigation into the numerical properties of the Hierarchical Reference Theory, we study the square well fluid of range lambda from slightly above unity up to 3.6. After briefly touching upon the core condition and the…

Condensed Matter · Physics 2009-11-07 Albert Reiner , Gerhard Kahl

Binary mixtures of hard-spheres with different diameters and square-well attraction between different particles are studied by theory and Monte Carlo simulations. In our mesoscopic theory, local fluctuations of the volume fraction of the…

Soft Condensed Matter · Physics 2021-10-04 O. Patsahan , A. Meyra , A. Ciach

We investigate several aspects of the thermodynamic geometry for a quantum fluid with square-well interactions using a third-order perturbation theory framework based on the path-integral-necklace analogy. A comparison is made between the…

A model for the radial distribution function $g(r)$ of a square-well fluid of variable width previously proposed [S. B. Yuste and A. Santos, J. Chem. Phys. {\bf 101}, 2355 (1994)] is revisited and simplified. The model provides an explicit…

Statistical Mechanics · Physics 2007-05-23 L. Acedo , A. Santos

A recent mode coupling theory of higher-order correlation functions is tested on a simple hard-sphere fluid system at intermediate densities. Multi-point and multi-time correlation functions of the densities of conserved variables are…

Statistical Mechanics · Physics 2009-11-07 Ramses van Zon , Jeremy Schofield

The vapor-liquid critical behavior of intrinsically asymmetric fluids is studied in finite systems of linear dimensions, $L$, focusing on periodic boundary conditions, as appropriate for simulations. The recently propounded ``complete''…

Statistical Mechanics · Physics 2009-11-10 Young C. Kim , Michael E. Fisher

The properties of one-dimensional liquids are studied for several interaction potentials for which, under certain assumptions, the properties of the system admit an analytical solution. The studied potentials are the triangle-well and the…

Soft Condensed Matter · Physics 2017-10-04 Ana M. Montero

We present a novel method to derive liquid-gas coexisting densities, $\rho^{\pm}(T)$, from grand canonical simulations (without knowledge of $\Tc$ or criticality class). The minima of $ Q_{L}\equiv< m^{2} >_{L}^{2}/< m^{4}>_{L}$ in an…

Statistical Mechanics · Physics 2009-11-10 Young C. Kim , Michael E. Fisher , Erik Luijten

Previously, it has been shown that the direct correlation function for a Lennard-Jones fluid could be modeled by a sum of that for hard-spheres, a mean-field tail and a simple linear correction in the core region constructed so as to…

Statistical Mechanics · Physics 2008-08-20 James F. Lutsko

We analytically examine fluctuations of vorticity excited by an external random force in two-dimensional fluid. We develop the perturbation theory enabling one to calculate nonlinear corrections to correlation functions of the flow…

Fluid Dynamics · Physics 2024-03-28 I. V. Kolokolov , V. V. Lebedev , V. M. Parfenyev
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