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000156452 0247_ $$2doi$$a10.1103/PhysRevE.90.033314
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000156452 1001_ $$0P:(DE-Juel1)144349$$aPoblete, Simón$$b0$$eCorresponding Author$$ufzj
000156452 245__ $$aHydrodynamics of discrete-particle models of spherical colloids: A multiparticle collision dynamics simulation study
000156452 260__ $$aCollege Park, Md.$$bAPS$$c2014
000156452 264_1 $$2Crossref$$3online$$bAmerican Physical Society (APS)$$c2014-09-29
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000156452 520__ $$aWe investigate the hydrodynamic properties of a spherical colloid model, which is composed of a shell of point particles by hybrid mesoscale simulations, which combine molecular dynamics simulations for the sphere with the multiparticle collision dynamics approach for the fluid. Results are presented for the center-of-mass and angular velocity correlation functions. The simulation results are compared with theoretical results for a rigid colloid obtained as a solution of the Stokes equation with no-slip boundary conditions. Similarly, analytical results of a point-particle model are presented, which account for the finite size of the simulated system. The simulation results agree well with both approaches on appropriative time scales; specifically, the long-time correlations are quantitatively reproduced. Moreover, a procedure is proposed to obtain the infinite-system-size diffusion coefficient based on a combination of simulation results and analytical predictions. In addition, we present the velocity field in the vicinity of the colloid and demonstrate its close agreement with the theoretical prediction. Our studies show that a point-particle model of a sphere is very well suited to describe the hydrodynamic properties of spherical colloids, with a significantly reduced numerical effort.
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000156452 7001_ $$0P:(DE-Juel1)131045$$aWysocki, Adam$$b1$$ufzj
000156452 7001_ $$0P:(DE-Juel1)130665$$aGompper, Gerhard$$b2$$ufzj
000156452 7001_ $$0P:(DE-Juel1)131039$$aWinkler, Roland G.$$b3$$ufzj
000156452 77318 $$2Crossref$$3journal-article$$a10.1103/physreve.90.033314$$bAmerican Physical Society (APS)$$d2014-09-29$$n3$$p033314$$tPhysical Review E$$v90$$x1539-3755$$y2014
000156452 773__ $$0PERI:(DE-600)2844562-4$$a10.1103/PhysRevE.90.033314$$gVol. 90, no. 3, p. 033314$$n3$$p033314$$tPhysical review / E$$v90$$x1539-3755$$y2014
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000156452 9201_ $$0I:(DE-Juel1)IAS-2-20090406$$kIAS-2$$lTheorie der Weichen Materie und Biophysik $$x0
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