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首页> 外文期刊>Bulletin of the Korean Chemical Society >Debye Screening Effect on Scaling Behavior of Longest Relaxation Time of Biological Polyelectrolyte Chain
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Debye Screening Effect on Scaling Behavior of Longest Relaxation Time of Biological Polyelectrolyte Chain

机译:德拜筛选对生物聚电解质链最长弛豫时间的结垢行为的影响

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摘要

The scaling relationship of the longest relaxation time of a single chain of semiflexible biological polyelectrolyte has been investigated by performing well-established coarse-grained Brownian dynamics simulations. Two kinds of longest relaxation times were estimated from time-sequences of chain traj ectories, and their behaviors were interpreted by applying the scaling law for different molecular weights of polyelectrolyte and Debye lengths. The scaling exponents for longest stress relaxation and rotational relaxation are found in the ranges of 1.67-1.79 and 1.65-1.81, respectively, depending on the physicochemical interaction of electrostatic Debye screening. The scaling exponent increases with decreasing screening effect, which is a special feature of polyelectrolytes differing from neutral polymers. It revealed that the weak screening allows a polyelectrolyte chain to follow the behavior in good solvent due to the strong electrostatic repulsion between beads.
机译:通过执行完善的粗粒度布朗动力学模拟,研究了半柔性生物聚电解质单链最长弛豫时间的比例关系。根据链轨迹的时间序列,估算出两种最长的弛豫时间,并通过对不同分子量的聚电解质和德拜长度应用比例定律来解释它们的行为。最长的应力松弛和旋转松弛的定标指数分别在1.67-1.79和1.65-1.81的范围内,这取决于静电德拜筛选的物理化学相互作用。结垢指数随筛选效果的降低而增加,这是不同于中性聚合物的聚电解质的一个特殊功能。结果表明,由于珠子之间的强静电排斥作用,弱筛选使得聚电解质链在良好的溶剂中能够遵循行为。

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