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The conformation change of model polymers in stochastic flow fields: Flow through fixed beds

 

作者: Alisa B. Mosler,   Eric S. G. Shaqfeh,  

 

期刊: Physics of Fluids  (AIP Available online 1997)
卷期: Volume 9, issue 5  

页码: 1222-1234

 

ISSN:1070-6631

 

年代: 1997

 

DOI:10.1063/1.869262

 

出版商: AIP

 

数据来源: AIP

 

摘要:

Simulations of the conformation change of model polymers in various steady, anisotropic Gaussian random flow fields are presented. These flow fields have been chosen because they are models for the flow through porous media and have been predicted to be “stochastic strong flows” according to the criteria developed by Shaqfeh and Koch [J. Fluid Mech.244, 17 (1992)]. To be specific, beyond a certain Deborah number (based on the sampling time of a velocity fluctuation), large average conformation change in the polymer is predicted. In our simulations, the polymers are modeled as dumbbells, but beyond this restriction, the assumptions of the theory by Shaqfeh and Koch are removed. Many realizations of the Gaussian fields are synthesized spectrally following a modified version of the method developed by Kraichnan [Phys. Fluids13, 22 (1970)]. Moreover, the ratio of the mean “plug” flow to the amplitude of the fluctuations is varied from mean-dominant to fluctuation-dominant flows. The simulated conformation change shows that, in fact, these flows are “strong” in the sense that the average second moment of the end-to-end distance becomes large (relative to equilibrium) beyond a critical value of the fluctuation Deborah number. Although qualitatively capturing these trends, the theory by Shaqfeh and Kochunderestimatesthe strength of the flows and thusoverestimatesthe critical Deborah number. We present a new theory which includes spring relaxation and Brownian motion in the sampling of a velocity fluctuation (two factors which were neglected in the existing theory), thereby breaking the fore–aft symmetry of the sampling, thus increasing the average polymer stretch. The new theory quantitatively predicts the simulation results. To the authors knowledge, this is the first evidence via direct simulation that these random flows can produce large conformation change in model polymer molecules, even when the mean flow would produce no such change. ©1997 American Institute of Physics.

 

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