当前位置: X-MOL 学术Phys. Rev. E › 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.)
Composition fluctuations in polydisperse liquids: Glasslike effects well above the glass transition
Physical Review E ( IF 2.2 ) Pub Date : 2020-10-16 , DOI: 10.1103/physreve.102.042611
L. Klochko , J. Baschnagel , J. P. Wittmer , O. Benzerara , C. Ruscher , A. N. Semenov

We study a two-dimensional glass-forming system of slightly polydisperse (LJ) particles using molecular dynamics simulations and demonstrate that in the liquid regime (well above the vitrification temperature) this model shows a number of features typical of the glass transition: (i) the relation between compressibility and structure factor S(q) is strongly violated; (ii) the dynamical structure factor S(q,t) at low q shows a two-step relaxation; (iii) the time-dependent heat capacity cv(t) shows a long-time power-law tail. We show that these phenomena can be rationalized with the idea of composition fluctuations and provide a quantitative theory for the effects (i) and (ii). It implies that such effects must be inherent in all polydisperse colloidal models, including binary LJ mixtures.

中文翻译:

多分散液体中的成分波动:玻璃样效果远高于玻璃化转变温度

我们使用分子动力学模拟研究了微分散(LJ)颗粒的二维玻璃形成系统,并证明在液体状态(远高于玻璃化温度)下,该模型显示出许多玻璃化转变的典型特征:压缩率与结构因子之间的关系 小号q受到严重侵犯;(ii)动力结构因素小号qŤq显示两步放松;(iii)随时间变化的热容量CvŤ显示了很长的幂律尾巴。我们表明,可以用成分波动的思想使这些现象合理化,并为效应(i)和(ii)提供定量理论。这意味着这种影响必须在所有多分散胶体模型中都固有,包括二元LJ混合物。
更新日期:2020-10-17
down
wechat
bug