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受限几何形状中聚合物链的单体密度分布:大场理论方法。

Monomer density profiles for polymer chains in confined geometries: massive field theory approach.

机构信息

Institute for Condensed Matter Physics, National Academy of Sciences of Ukraine, 79011 Lviv, Ukraine.

出版信息

J Chem Phys. 2011 Jan 14;134(2):024119. doi: 10.1063/1.3529426.

Abstract

Taking into account the well known correspondence between the field theoretical ϕ(4) O(n)-vector model in the limit n → 0 and the behavior of long flexible polymer chains in a good solvent, the universal density-force relation is analyzed and the corresponding universal amplitude ratio B(real) is obtained using the massive field theory approach in fixed space dimensions d < 4. The monomer density profiles of ideal chains and real polymer chains with excluded volume interaction in a good solvent between two parallel repulsive walls, one repulsive and one inert wall, are obtained in the framework of the massive field theory approach up to one-loop order. Besides, the monomer density profiles for the dilute polymer solution confined in semi-infinite space containing mesoscopic spherical particle of big radius are calculated. The obtained results are in qualitative agreement with previous theoretical investigations and with the results of Monte Carlo simulations.

摘要

考虑到众所周知的在 n → 0 极限下场论中的 ϕ(4) O(n)-向量模型与在良溶剂中长柔性聚合物链的行为之间的对应关系,使用固定空间维度 d < 4 中的大质量场论方法分析了通用密度-力关系,并获得了相应的通用幅度比 B(real)。在大质量场论方法的框架内,我们还获得了在两种平行排斥壁之间的良溶剂中具有排斥和惰性壁的理想链和具有排斥相互作用的真实聚合物链的单体密度分布,直到一阶。此外,我们还计算了在包含大半径介观球形粒子的半无限空间中受限的稀聚合物溶液的单体密度分布。所得结果与以前的理论研究和蒙特卡罗模拟的结果定性一致。

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