Modeling diffusion of adsorbed polymer with explicit solvent

被引:47
作者
Desai, Tapan G. [1 ]
Keblinski, Pawel
Kumar, Sanat K.
Granick, Steve
机构
[1] Rensselaer Polytech Inst, Dept Mat Sci & Engn, Troy, NY 12181 USA
[2] Columbia Univ, Dept Chem Engn, New York, NY USA
[3] Univ Illinois, Dept Mat Sci & Engn, Urbana, IL 61801 USA
[4] Univ Illinois, Dept Chem, Urbana, IL 61801 USA
[5] Univ Illinois, Dept Phys, Urbana, IL 61801 USA
关键词
D O I
10.1103/PhysRevLett.98.218301
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Computer simulations of a polymer chain of length N strongly adsorbed at the solid-liquid interface in the presence of explicit solvent are used to delineate the factors affecting the N dependence of the polymer lateral diffusion coefficient, D-parallel to. We find that surface roughness has a large influence, and D-parallel to scales as D-parallel to similar to N-x, with x approximate to 3/4 and x approximate to 1 for ideal smooth and corrugated surfaces, respectively. The first result is consistent with the hydrodynamics of a "particle" of radius of gyration R-G similar to N-nu (nu=0.75) translating parallel to a planar interface, while the second implies that the friction of the adsorbed chains dominates. These results are discussed in the context of recent measurements.
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页数:4
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