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We present numerical calculations of a four-point dynamic susceptibility, chi_4(t), for the Kob-Andersen Lennard-Jones mixture as a function of temperature T and density rho. Over a relevant range of T and rho, the full t-dependence of…

Statistical Mechanics · Physics 2009-10-20 D. Coslovich , C. M. Roland

We calculate the shear relaxation times in four important simple monatomic model fluids: Lennard-Jones, Yukawa, soft-sphere and hard-sphere fluids. It is observed that in properly reduced units, the shear relaxation times exhibit…

Soft Condensed Matter · Physics 2024-12-11 S. A. Khrapak , A. G. Khrapak

We investigate the origin of the density depletion and enhanced density fluctuations that occur in water in the vicinity of an extended hydrophobic solute. We argue that both phenomena are remnants of the critical drying surface phase…

Soft Condensed Matter · Physics 2022-02-09 Mary K. Coe , Robert Evans , Nigel B. Wilding

We show that for any liquid or solid with strong correlation between its $NVT$ virial and potential-energy equilibrium fluctuations, the temperature is a product of a function of excess entropy per particle and a function of density,…

Soft Condensed Matter · Physics 2012-03-13 Trond S. Ingebrigtsen , Lasse Bøhling , Thomas B. Schrøder , Jeppe C. Dyre

Using molecular dynamics simulations we investigate the finite-size dependence of the dynamical properties of a diatomic supercooled liquid. The simplicity of the molecule permits us to access the microsecond time scale. We find that the…

Soft Condensed Matter · Physics 2017-12-06 Sonia Taamalli , Julia Hinds , Samuel Migirditch , Victor Teboul

We use molecular dynamics simulations to study the behavior of a compressible Lennard-Jones fluid in simple shear flow in a two-dimensional nanochannel. The system is equilibrated in the fluid phase close to the triple point at which gas,…

Soft Condensed Matter · Physics 2017-03-31 Madhu Priya , Yitzhak Rabin

The macroscopic behavior of dense suspensions of neutrally-buoyant spheres in turbulent plane channel flow is examined. We show that particles larger than the smallest turbulence scales cause the suspension to deviate from the continuum…

Fluid Dynamics · Physics 2016-09-28 Pedro Costa , Francesco Picano , Luca Brandt , Wim-Paul Breugem

Quantum effects in material systems are often pronounced at low energies and become insignificant at high temperatures. We find that, perhaps counterintuitively, certain quantum effects may follow the opposite route and become sharp when…

Statistical Mechanics · Physics 2015-09-08 Z. Nussinov , F. Nogueira , M. Blodgett , K. F. Kelton

We study a three-dimensional system of self-propelled Lennard-Jones particles using Brownian Dynamics simulations. Using recent theoretical results for active matter, we calculate the pressure and report equations of state for the system.…

Soft Condensed Matter · Physics 2016-10-04 Vasileios Prymidis , Siddharth Paliwal , Marjolein Dijkstra , Laura Filion

The Soret effect is the tendency of fluid mixtures to exhibit concentration gradients in the presence of a temperature gradient. Using molecular-dynamics simulation of two-component Lennard-Jones liquids, it is demonstrated that…

Soft Condensed Matter · Physics 2023-02-08 Patrick K. Schelling

Results for the kinetics of vapor-liquid transitions, following temperature quenches with different densities, are presented from the molecular dynamics simulations of a Lennard-Jones system. For critical density, bicontinuous liquid and…

Statistical Mechanics · Physics 2018-03-09 Sutapa Roy , Subir K. Das

The liquid and supercooled states of water show a series of anomalies whose nature is debated. A key role is attributed to the formation of structural aggregates induced by critical phenomena occurring deep in the supercooled region; the…

Chemical Physics · Physics 2013-12-18 A. Taschin , P. Bartolini , R. Eramo , R. Righini , R. Torre

We study the kinetics of domain growth of fluid mixtures quenched from a disordered to a lamellar phase. At low viscosities, in two dimensions, when hydrodynamic modes become important, dynamical scaling is verified in the form $C(\vec k,…

Soft Condensed Matter · Physics 2016-08-31 Aiguo Xu , G. Gonnella , A. Lamura , G. Amati , F. Massaioli

Power law is one of the the simplest forms of the relationship between different variables of a system. It leads naturally to the introduction of compound parameters describing physical properties of the system. Often one of the variables…

Materials Science · Physics 2007-05-23 Alexander M. Korsunsky

We analyze the behavior of supercooled fluids under shear both theoretically and numerically. Theoretically, we generalize the mode-coupling theory of supercooled fluids to systems under stationary shear flow. Our starting point is the set…

Soft Condensed Matter · Physics 2009-11-10 Kunimasa Miyazaki , David R. Reichman , Ryoichi Yamamoto

Simulations are used to determine the effect of inertia on athermal shear of a two-dimensional binary Lennard-Jones glass. In the quasistatic limit, shear occurs through a series of rapid avalanches. The distribution of avalanches is…

Soft Condensed Matter · Physics 2013-09-04 K. Michael Salerno , Craig E. Maloney , Mark O. Robbins

We present the results of a Molecular Dynamics computer simulation of a binary Lennard-Jones liquid confined in a narrow pore. The surface of the pore has an amorphous structure similar to that of the confined liquid. We find that the…

Statistical Mechanics · Physics 2007-05-23 Peter Scheidler , Walter Kob , Kurt Binder

We demonstrate, via numerical simulations, that the relaxation dynamics of supercooled liquids correlates well with a plastic length scale measuring a particle's response to impulsive localized perturbations and weakly to measures of local…

Soft Condensed Matter · Physics 2022-06-23 Yan-Wei Li , Yugui Yao , Massimo Pica Ciamarra

Size-polydisperse liquids have become standard models for avoiding crystallization, thereby enabling studies of supercooled liquids and glasses formed, e.g., by colloidal systems. Purely \textit{energy} polydisperse liquids have been…

Soft Condensed Matter · Physics 2023-03-31 Trond S. Ingebrigtsen , Jeppe C. Dyre

We have studied the superfluid density $\rho_{s}$ on various size-lattices in the geometry $L \times L \times H$ by numerical simulation of the $x-y$ model using the Cluster Monte Carlo method. Applying the Kosterlitz-Thouless-Nelson…

Condensed Matter · Physics 2009-10-22 N. Schultka , E. Manousakis