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Density functional study of surface forces in solutions containing star-shaped polymers

机译:含星形聚合物溶液中表面力的密度泛函研究

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Density functional theory is used to study polymer solutions between surfaces in equilibrium with a bulk solution. We investigate the effect on the surface interaction free energy of having star polymers with different numbers of arms. In addition, we consider the role played by the strength of the adsorption potential and the concentration of the polymer molecules. The interaction free energy is found to scale quite well with the number of arms on the stars, and the separation dependence of the interaction scales approximately with the radius of gyration. When the adsorption potential is weak, the polymer molecules are depleted. A free energy barrier is nevertheless present-a phenomenon often referred to as depletion stabilization. The barrier scales with the number of arms on the star polymers.
机译:密度泛函理论用于研究与本体溶液处于平衡状态的表面之间的聚合物溶液。我们研究了具有不同臂数的星形聚合物对表面相互作用自由能的影响。此外,我们考虑了吸附电位强度和聚合物分子浓度所起的作用。发现相互作用的自由能与恒星上的臂数成比例地很好地缩放,并且相互作用的分离依存关系大约与回转半径成比例。当吸附势弱时,聚合物分子耗尽。尽管如此,仍然存在自由能垒-这种现象通常称为耗尽稳定。阻挡层随星形聚合物上的臂数缩放。

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