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首页> 外文期刊>The European physical journal: Special topics >Molecular dynamics studies of slow dynamics in random media: Type A-B and reentrant transitions
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Molecular dynamics studies of slow dynamics in random media: Type A-B and reentrant transitions

机译:随机介质中慢动力学的分子动力学研究:A-B型和折返过渡

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摘要

Molecular dynamics simulations of mobile particles confined in disordered immobile particles are carried out. Slow dynamics in random media are characterized by two types of dynamics: Type B dynamics for large mobile particle density and Type A dynamics for small mobile particle density. The crossover from Type A to B dynamics is studied by the mean square displacement and the density correlation function. Our results are qualitatively consistent with the results of recent numerical and theoretical studies on relevant spatially het-erogeneous systems. We also investigate the effect of random matrix generation on the dynamics of mobile particles in order to examine the reentrant transition predicted by the recent mode-coupling theory. Our simulations demonstrate that the diffusion of the mobile particles largely depends on the protocol of the random matrix generation and that the reentrant transition is observed for a particular protocol
机译:进行了限制在无序固定粒子中的移动粒子的分子动力学模拟。随机介质中的慢动力学具有两种动力学特征:对于较大的移动粒子密度,B型动力学;对于较小的移动粒子密度,A型动力学。通过均方位移和密度相关函数研究从A型动力学到B型动力学的交叉。我们的结果与有关空间异质系统的最新数值和理论研究的结果在质量上是一致的。我们还研究了随机矩阵生成对移动粒子动力学的影响,以检查最近的模式耦合理论预测的折返过渡。我们的仿真表明,可移动粒子的扩散很大程度上取决于随机矩阵生成的协议,并且对于特定协议,可观察到折返过渡

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