当前位置: X-MOL 学术J. Chem. Phys. › 论文详情
Our official English website, www.x-mol.net, welcomes your feedback! (Note: you will need to create a separate account there.)
Communication: Fast dynamics perspective on the breakdown of the Stokes-Einstein law in fragile glassformers
The Journal of Chemical Physics ( IF 3.1 ) Pub Date : 2018-04-05 , DOI: 10.1063/1.5025614
F. Puosi 1 , A. Pasturel 1 , N. Jakse 1 , D. Leporini 2
Affiliation  

The breakdown of the Stokes-Einstein (SE) law in fragile glassformers is examined by Molecular-Dynamics simulations of atomic liquids and polymers and consideration of the experimental data concerning the archetypical ortho-terphenyl glassformer. All the four systems comply with the universal scaling between the viscosity (or the structural relaxation) and the Debye-Waller factor ⟨u2⟩, the mean square amplitude of the particle rattling in the cage formed by the surrounding neighbors. It is found that the SE breakdown is scaled in a master curve by a reduced ⟨u2⟩. Two approximated expressions of the latter, with no and one adjustable parameter, respectively, are derived.

中文翻译:

交流:脆弱的玻璃成型机中斯托克斯-爱因斯坦定律分解的快速动力学视角

通过分子液体和聚合物的分子动力学模拟,并考虑有关原型三联苯玻璃形成剂的实验数据,研究了易碎玻璃形成器中斯托克斯-爱因斯坦(SE)定律的分解。所有这四个系统都符合粘度(或结构弛豫)与Debye-Waller因子⟨u 2 between之间的通用标度,Debye-Waller因子u 2是在周围的邻居形成的笼子中发出咔嗒声的均方振幅。发现SE击穿在主曲线中按减少的u u 2来缩放。推导了后者的两个近似表达式,分别没有参数和一个可调参数。
更新日期:2018-04-07
down
wechat
bug