4.7 Article Proceedings Paper

Simulation of complex fluids by multi-particle-collision dynamics

Journal

COMPUTER PHYSICS COMMUNICATIONS
Volume 169, Issue 1-3, Pages 326-330

Publisher

ELSEVIER SCIENCE BV
DOI: 10.1016/j.cpc.2005.03.073

Keywords

molecular dynamics simulations; mesoscale simulations; MPCD; hybrid simulations; complex fluids; colloids; polymers

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The particle-based mesoscale simulation technique called Multi-Particle-Collision Dynamics (MPCD) (also denoted as Stochastic Rotation Dynamics (SDR)) is introduced. The algorithm is outlined and applications to complex fluids are described. Results for the dynamics of a Gaussian polymer and a rodlike colloid are discussed. Moreover, the density dependence of the diffusion coefficient of a colloidal fluid is presented. Our investigations show that the MPCD algorithm accounts for hydrodynamic interactions. (c) 2005 Elsevier B.V. All rights reserved.

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