分子动力学
碳酸丙烯酯
缩放比例
动态缩放
可见的
动力学(音乐)
统计物理学
玻璃化转变
化学物理
材料科学
物理
化学
数学
物理化学
计算化学
聚合物
量子力学
电化学
几何学
复合材料
声学
电极
作者
J. Qian,Reinhard Hentschke,Andreas Heuer
摘要
We employ classical Molecular Dynamics simulations to study the cooperative dynamics of two low molecular weight glass-formers, propylene carbonate and salol. The length scales of dynamic heterogeneities are estimated. After appropriate scaling both glass-formers display a similar temperature dependence of this length scale. Local structural properties like density, regularity, and potential energy are correlated with different local dynamical observables. We find that the dynamic heterogeneities are most strongly related to the local potential energy. To obtain an optimum correlation the local dynamics has to be characterized by the residence time.
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