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A symmetrical binary, A+B Lennard-Jones mixture is studied by a combination of semi-grandcanonical Monte Carlo (SGMC) and Molecular Dynamics (MD) methods near a liquid-liquid critical temperature $T_c$. Choosing equal chemical potentials…

统计力学 · 物理学 2009-11-11 Subir K. Das , Juergen Horbach , Kurt Binder , Michael E. Fisher , Jan V. Sengers

We report comprehensive simulations of the critical dynamics of a symmetric binary Lennard-Jones mixture near its consolute point. The self-diffusion coefficient exhibits no detectable anomaly. The data for the shear viscosity and the…

统计力学 · 物理学 2009-11-11 Subir K. Das , Michael E. Fisher , Jan V. Sengers , Juergen Horbach , Kurt Binder

We report a Monte Carlo finite-size scaling study of the demixing transition of a symmetrical Lennard-Jones binary fluid mixture. For equal concentration of species, and for a choice of the unlike-to-like interaction ratio delta=0.7, this…

统计力学 · 物理学 2009-11-10 Nigel B. Wilding

We use Monte Carlo and molecular dynamics simulations to study phase behavior and transport properties in a symmetric binary fluid where particles interact via Lennard-Jones potential. Our results for the critical behavior of collective…

统计力学 · 物理学 2018-03-09 Sutapa Roy , Subir K. Das

We use simulation-based supervised machine learning and classical density functional theory to investigate bulk and interfacial phenomena associated with phase coexistence in binary mixtures. For a prototypical symmetrical Lennard-Jones…

软凝聚态物质 · 物理学 2025-10-23 Silas Robitschko , Florian Sammüller , Matthias Schmidt , Robert Evans

The microscopic approach to the description of the phase behaviour and critical phenomena in binary fluid mixtures is proposed. It is based on the method of collective variables with a reference system. The physical nature of the order…

凝聚态物理 · 物理学 2009-10-31 O. V. Patsahan

A Lennard--Jones model of a binary dense liquid (A,B) with a symmetrical miscibility gap is investigated by means of computer simulation methods. Semigrand--canonical Monte Carlo simulations yield the phase diagram in the $T$--$x$ plane…

统计力学 · 物理学 2007-05-23 Subir K. Das , Jürgen Horbach , Kurt Binder

A binary liquid near its consolute point exhibits critical fluctuations of the local composition; the diverging correlation length has always challenged simulations. The method of choice for the calculation of critical points in the phase…

统计力学 · 物理学 2021-04-29 Yogyata Pathania , Dipanjan Chakraborty , Felix Höfling

We consider the liquid-gas phase boundary in a binary fluid mixture near its critical end point. Using general scaling arguments we show that the diameter of the liquid-gas coexistence curve exhibits singular behaviour as the critical end…

统计力学 · 物理学 2016-08-31 Nigel B. Wilding

The gas-liquid phase transition of the three-dimensional Lennard-Jones particles system is studied by molecular dynamics simulations. The gas and liquid densities in the coexisting state are determined with high accuracy. The critical point…

统计力学 · 物理学 2013-11-28 Hiroshi Watanabe , Nobuyasu Ito , Chin-Kun Hu

Static and dynamic structure factors and various transport coefficients are computed for a Lennard-Jones model of a binary fluid (A,B) with a symmetrical miscibility gap, varying both temperature and relative concentration of the mixture.…

统计力学 · 物理学 2009-11-10 Subir K. Das , Jürgen Horbach , Kurt Binder

The phase behavior of binary fluid mixtures of hard hyperspheres in four and five dimensions is investigated. Spinodal instability is found by using a recent and accurate prescription for the equation of state of the mixture that requires…

统计力学 · 物理学 2016-08-15 S. B. Yuste , A. Santos , M. López de Haro

We study equilibrium dynamics of a symmetrical binary Lennard-Jones fluid mixture near its consolute criticality. Molecular dynamics simulation results for shear viscosity, $\eta$, from microcanonical ensemble are compared with those from…

统计力学 · 物理学 2018-03-09 Sutapa Roy , Subir K. Das

We experimentally study the critical properties of the non-equilibrium solid-liquid-like transition that takes place in vibrated granular matter. The critical dynamics is characterized by the coupling of the density field with the…

统计力学 · 物理学 2015-06-23 Gustavo Castillo , Nicolás Mujica , Rodrigo Soto

Results for transport properties, in conjunction with phase behavior and thermodynamics, are presented at the criticality of a binary Lennard-Jones fluid from Monte Carlo and molecular dynamics simulations. Evidence for much stronger…

统计力学 · 物理学 2018-04-17 Sutapa Roy , Subir K. Das

Monte Carlo simulations within the grand canonical ensemble are used to explore the liquid-vapour coexistence curve and critical point properties of the Lennard-Jones fluid. Attention is focused on the joint distribution of density and…

凝聚态物理 · 物理学 2009-10-28 Nigel B. Wilding

With the objective of demonstrating usefulness of thermostats in the study of dynamic critical phenomena in fluids, we present results for transport properties in a binary Lennard-Jones fluid that exhibits liquid-liquid phase transition.…

统计力学 · 物理学 2018-04-17 Sutapa Roy , Subir K. Das

Via a combination of molecular dynamics (MD) simulations and finite-size scaling (FSS) analysis, we study dynamic critical phenomena for the vapor-liquid transition in a three dimensional Lennard-Jones system. The phase behavior of the…

统计力学 · 物理学 2017-08-18 Jiarul Midya , Subir K. Das

We consider a binary fluid mixture, which lies in the one-phase region near the demixing critical point, and study its transport through a capillary tube linking two large reservoirs. We assume that short-range interactions cause…

软凝聚态物质 · 物理学 2023-09-21 Youhei Fujitani , Shunsuke Yabunaka

It is well known that the similar universal behavior of infinite-size (bulk) systems of different nature requires the same basic conditions: space dimensionality; number components of order parameter; the type (short- or long-range) of the…

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