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Magnetic-Induced Coil-Globule Transition for Polyelectrolytes

机译:聚电解质的磁感应线圈小球跃迁

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The effects of an applied magnetic field on the system composed of polyelectrolytes (PEs) and magnetic nanoparticles oppositely charged are studied by means of Monte Carlo method within the framework of "single-site bond fluctuation model." For a certain concentration of chains, the coil-globule transition can be induced by the applied magnetic field. The mean-square end-to-end distance and gyration radius as well as the shape factor of PE chains are used to characterize the conformational transitions. The statistical analysis of the system energy demonstrates this significant physical process. The role of entropy-energy balance is well-understood for different chain lengths, and a typical phase-transition anomaly concerned with specific heat curve is observed. Under a certain magnetic field, the PE chains will regularly collapse due to the enough adsorption of magnetic particles. The magnetic particles exhibit peculiar spatial distribution at high magnetic fields: the string-like arrangement along the magnetic field and the square lattice-like arrangement perpendicular to the magnetic field. The applied magnetic field has a great influence on the length of string-like structures formed by nanoparticles. This investigation may cast light on the collapse of PEs and provide a promising method for producing new nanocomposites.
机译:在“单中心键涨落模型”的框架内,通过蒙特卡罗方法研究了外加磁场对由聚电解质(PEs)和带相反电荷的磁性纳米粒子组成的体系的影响。对于一定浓度的链,可以通过施加的磁场感应线圈-小球过渡。均方根端到端的距离和回转半径以及PE链的形状因子用于表征构象转变。系统能量的统计分析表明了这一重要的物理过程。对于不同的链长,熵-能量平衡的作用是众所周知的,并且观察到典型的与比热曲线有关的相变异常。在一定的磁场作用下,由于磁性颗粒的充分吸附,PE链会定期塌陷。磁性粒子在强磁场下表现出特殊的空间分布:沿着磁场的线状排列和垂直于磁场的方格状排列。施加的磁场对纳米颗粒形成的线状结构的长度有很大的影响。这项研究可能为PE的崩溃提供了启示,并为生产新型纳米复合材料提供了有希望的方法。

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