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Homogeneous shear flows (with constant strainrate du/dy) are generated with the Doll's and Sllod algorithms and compared to corresponding inhomogeneous boundary-driven flows. We use one-, two-, and three-dimensional smooth-particle weight…

Chaotic Dynamics · Physics 2013-05-29 Wm. G. Hoover , Carol G. Hoover , Janka Petravic

Cell dynamics simulation is used to investigate the phase behavior of block copolymer/homopolymer mixture subjected to a steady shear flow. Phase transitions occur from transverse to parallel and then to perpendicular lamellar structure…

Soft Condensed Matter · Physics 2015-06-29 Y. Guo , J. Zhang , B. Wang , H. Wu , M. Sun , J. Pan

We study shear yielding and steady state flow of glassy materials with molecular dynamics simulations of two standard models: amorphous polymers and bidisperse Lennard-Jones glasses. For a fixed strain rate, the maximum shear yield stress…

Soft Condensed Matter · Physics 2009-11-10 Joerg Rottler , Mark O. Robbins

The dynamic behavior of the slip length in a fluid flow confined between atomically smooth surfaces is investigated using molecular dynamics simulations. At weak wall-fluid interactions, the slip length increases nonlinearly with the shear…

Soft Condensed Matter · Physics 2007-10-14 Nikolai V. Priezjev

The stochastic motion of a two-dimensional vesicle in linear shear flow is studied at finite temperature. In the limit of small deformations from a circle, Langevin-type equations of motion are derived, which are highly nonlinear due to the…

Soft Condensed Matter · Physics 2009-11-13 Reimar Finken , Antonio Lamura , Udo Seifert , Gerhard Gompper

A consistent description of a shear flow, the accompanied viscous heating, and the associated entropy balance is given in the framework of a deterministic dynamical system, where a multibaker dynamics drives two fields: the velocity and the…

Chaotic Dynamics · Physics 2009-10-31 Tamas Tel , Juergen Vollmer , Laszlo Matyas

We investigate by Molecular Dynamics simulation a system of $N$ particles moving on the surface of a two-dimensional sphere and interacting by a Lennard-Jones potential. We detail the way to account for the changes brought by a nonzero…

Statistical Mechanics · Physics 2015-06-18 Julien-Piera Vest , Gilles Tarjus , Pascal Viot

The competition between the drive and stabilization of plasma microinstabilities by sheared flow is investigated, focusing on the ion temperature gradient mode. Using a twisting mode representation in sheared slab geometry, the…

Plasma Physics · Physics 2015-05-19 Sarah L. Newton , Steve C. Cowley , Nuno F. Loureiro

The continuum theory of partially fluidized shear granular flows is tested and calibrated using two dimensional soft particle molecular dynamics simulations. The theory is based on the relaxational dynamics of the order parameter that…

Materials Science · Physics 2009-11-10 D. Volfson , L. S. Tsimring , I. S. Aranson

In this paper, we investigate the motion of a neutrally buoyant cylinder of an elliptic shape freely moving in two dimensional shear flow by direct numerical simulation. An elliptic shape cylinder in shear flow, when initially being placed…

Fluid Dynamics · Physics 2015-09-30 Shih-Lin Huang , Shih-Di Chen , Tsorng-Whay Pan , Chien-Cheng Chang , Chin-Chou Chu

We use numerical simulations to study the flow of athermal, frictionless, soft-core two dimensional spherocylinders driven by a uniform steady-state simple shear applied at a fixed volume and a fixed finite strain rate $\dot\gamma$. Energy…

Soft Condensed Matter · Physics 2020-03-30 Theodore A. Marschall , S. Teitel

Molecular dynamics simulations are carried out to investigate the dynamic behavior of the slip length in thin polymer films confined between atomically smooth thermal surfaces. For weak wall-fluid interactions, the shear rate dependence of…

Soft Condensed Matter · Physics 2008-04-21 Anoosheh Niavarani , Nikolai V. Priezjev

To learn about basic aspects of nano-scale spherical molecular shells during their formation, spherically curved two-dimensional N-particle Lennard-Jones systems are simulated, studying curvature evolution paths at zero-temperature. For…

Atomic and Molecular Clusters · Physics 2009-11-11 J. M. Voogd , P. M. A. Sloot , R. van Dantzig

Knowledge of relaxation processes is fundamental in glass science and technology because relaxation is intrinsically related to vitrification, tempering as well as to annealing and sev-eral applications of glasses. However, there are…

Soft Condensed Matter · Physics 2021-03-17 Ricardo F. Lancelotti , Daniel R. Cassar , Marcelo Nalin , Oscar Peitl , Edgar D. Zanotto

The properties of semidilute polymer solutions are investigated at equilibrium and under shear flow by mesoscale simulations, which combine molecular dynamics simulations and the multiparticle collision dynamics approach. In semidilute…

Soft Condensed Matter · Physics 2015-03-19 Chien-Cheng Huang , Roland G. Winkler , Godehard Sutmann , Gerhard Gompper

A non-equilibrium steady state thermodynamics to describe shear flows is developed using a canonical distribution approach. We construct a canonical distribution for shear flow based on the energy in the moving frame using the Lagrangian…

Statistical Mechanics · Physics 2007-05-23 Tooru Taniguchi , Gary P. Morriss

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

We investigate the intrinsic behavior of ionic liquids under shear flow, using a coarse-grained model of C4mim-PF6 as a prototypical example. The importance of long-ranged electrostatics is assessed as a function of shear rate by comparing…

We investigate numerically the dynamics of a single polymer in a linear shear flow. The effects of thermal fluctuations and randomly fluctuating velocity gradients are both analyzed. Angular, elongation and tumbling time statistics are…

Chaotic Dynamics · Physics 2009-11-11 A. Puliafito , K. Turitsyn

We investigate a binary Lennard-Jones mixture with molecular dynamics simulations. We consider first a system cooled linearly in time with the cooling rate gamma. By varying gamma over almost four decades we study the influence of the…

Statistical Mechanics · Physics 2015-06-25 K. Vollmayr-Lee , W. Kob , K. Binder , A. Zippelius