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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.…

Statistical Mechanics · Physics 2018-04-17 Sutapa Roy , Subir K. Das

Correlation functions and transport coefficients of self-diffusion and shear viscosity of a binary Lennard-Jones mixture with components differing only in their particle mass are studied up to high values of the mass ratio $\mu$, including…

Soft Condensed Matter · Physics 2015-05-13 W. Fenz , I. M. Mryglod , O. Prytula , R. Folk

Finite-size effects in systems with diverging characteristic lengthscale have been addressed via state-of-the-art Monte Carlo and molecular dynamics simulations of various models exhibiting solid-solid, liquid-liquid and vapor-liquid…

Statistical Mechanics · Physics 2018-03-09 Subir K. Das , Sutapa Roy , Suman Majumder , Shaista Ahmad

We describe a Monte Carlo scheme for the grand canonical simulation study of fluid phase equilibria in highly size-asymmetrical binary mixtures. The method utilizes an expanded ensemble in which the insertion and deletion of large particles…

Soft Condensed Matter · Physics 2015-05-18 Douglas J. Ashton , Nigel B. Wilding

A microscopic approach to the investigation of the behaviour of a symmetrical binary fluid mixture in the vicinity of the vapour-liquid critical point is proposed. It is shown that the problem can be reduced to the calculation of the…

Condensed Matter · Physics 2009-10-31 O. V. Patsahan , M. P. Kozlovskii , R. S. Melnyk

Via hydrodynamics preserving molecular dynamics simulations we study growth phenomena in a phase separating symmetric binary mixture model. We quench high-temperature homogeneous configurations to state points inside the miscibility gap,…

Soft Condensed Matter · Physics 2021-07-23 Koyel Das , Subir K. Das

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

Molecular dynamics simulations of miscible and partially miscible binary Lennard--Jones mixtures are used to study the dynamics and thermodynamics of vapor condensation onto a non-volatile liquid drop in the canonical ensemble. When the…

Soft Condensed Matter · Physics 2015-06-17 Levent Inci , Richard. K. Bowles

We investigate the dynamical behavior of binary fluid systems in two dimensions using dissipative particle dynamics. We find that following a symmetric quench the domain size R(t) grows with time t according to two distinct algebraic laws…

comp-gas · Physics 2009-10-28 Peter V. Coveney , Keir E. Novik

The nonequilibrium dynamics of a binary Lennard-Jones mixture in a simple shear flow is investigated by means of molecular dynamics simulations. The range of temperature investigated covers both the liquid, supercooled and glassy states,…

Soft Condensed Matter · Physics 2009-11-07 Ludovic Berthier , Jean-Louis Barrat

Critical behaviour of a fluid, subjected to strongly anisotropic turbulent mixing, is studied by means of the field theoretic renormalization group. As a simplified model, relaxational stochastic dynamics of a non-conserved scalar order…

Statistical Mechanics · Physics 2008-11-26 N. V. Antonov , A. A. Ignatieva

In recent years lines along which structure and dynamics are invariant to a good approximation, so-called isomorphs, have been identified in the thermodynamic phase diagrams of several model liquids and solids. This paper reports computer…

Soft Condensed Matter · Physics 2022-04-14 Solvej Knudsen , B. D. Todd , Jeppe C. Dyre , J. S. Hansen

Explicit simulations of fluid mixtures of highly size-dispersed particles are constrained by numerical challenges associated with identifying pair-interaction neighbors. Recent algorithmic developments have ameliorated these difficulties to…

Soft Condensed Matter · Physics 2022-12-07 Joseph M. Monti , Gary S. Grest

We study diffusive dynamics of phase separation in a binary mixture, following critical quench, both in spatial dimensions $d=2$ and $d=3$. Particular focus in this work is to obtain information about effects of system size and correction…

Statistical Mechanics · Physics 2015-05-27 Suman Majumder , Subir K. Das

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…

Statistical Mechanics · Physics 2013-11-28 Hiroshi Watanabe , Nobuyasu Ito , Chin-Kun Hu

The problem of demixing in a binary fluid mixture of highly asymmetric additive hard spheres is revisited. A comparison is presented between the results derived previously using truncated virial expansions for three finite size ratios with…

Soft Condensed Matter · Physics 2013-05-03 Mariano López de Haro , Carlos F. Tejero , Andrés Santos

We simulate by lattice Boltzmann the steady shearing of a binary fluid mixture with full hydrodynamics in three dimensions. Contrary to some theoretical scenarios, a dynamical steady state is attained with finite correlation lengths in all…

Statistical Mechanics · Physics 2009-11-13 K. Stratford , J. -C. Desplat , P. Stansell , M. E. Cates

The thermodynamic behavior of a fluid near a vapor-liquid and, hence, asymmetric critical point is discussed within a general ``complete'' scaling theory incorporating pressure mixing in the nonlinear scaling fields as well as corrections…

Statistical Mechanics · Physics 2009-11-07 Young C. Kim , Michael E. Fisher , G. Orkoulas

We present molecular dynamics simulation results for the viscosity and mutual diffusion constant of a strongly asymmetric binary ionic mixture (BIM). We compare the results with available theoretical models previously tested for much…

Plasma Physics · Physics 2007-05-23 Sorin Bastea

We investigate the kinetics of bubble coarsening in a single component Lennard-Jones fluid using large-scale molecular dynamics simulations. A homogeneous high-temperature system is quenched below the critical temperature to induce the…

Soft Condensed Matter · Physics 2025-09-29 Parameshwaran A , Bhaskar Sen Gupta