Zhang Bo-kai, Li Hui-shu, Tian Wen-de, Chen Kang, Ma Yu-qiang
National Laboratory of Solid State Microstructures and Department of Physics, Nanjing University, Nanjng 210093, People's Republic of China.
Center for Soft Condensed Matter Physics and Interdisciplinary Research, Soochow University, Suzhou 215006, People's Republic of China.
J Chem Phys. 2014 Mar 7;140(9):094506. doi: 10.1063/1.4866903.
The microscopic nonlinear Langevin equation theory is applied to study the localization and activated hopping of two-dimensional hard disks in the deeply supercooled and glass states. Quantitative comparisons of dynamic characteristic length scales, barrier, and their dependence on the reduced packing fraction are presented between hard-disk and hard-sphere suspensions. The dynamic barrier of hard disks emerges at higher absolute and reduced packing fractions and correspondingly, the crossover size of the dynamic cage which correlates to the Lindemann length for melting is smaller. The localization lengths of both hard disks and spheres decrease exponentially with packing fraction. Larger localization length of hard disks than that of hard spheres is found at the same reduced packing fraction. The relaxation time of hard disks rises dramatically above the reduced packing fraction of 0.88, which leads to lower reduced packing fraction at the kinetic glass transition than that of hard spheres. The present work provides a foundation for the subsequent study of the glass transition of binary or polydisperse mixtures of hard disks, normally adopted in experiments and simulations to avoid crystallization, and further, the rheology and mechanical response of the two-dimensional glassy colloidal systems.
应用微观非线性朗之万方程理论研究二维硬磁盘在深度过冷和玻璃态下的局域化和活化跳跃。给出了硬磁盘和硬球悬浮液之间动态特征长度尺度、势垒及其对约化堆积分数的依赖性的定量比较。硬磁盘的动态势垒出现在更高的绝对堆积分数和约化堆积分数下,相应地,与熔化的林德曼长度相关的动态笼的交叉尺寸更小。硬磁盘和硬球的局域化长度均随堆积分数呈指数下降。在相同的约化堆积分数下,发现硬磁盘的局域化长度比硬球的局域化长度更大。硬磁盘的弛豫时间在约化堆积分数高于0.88时急剧上升,这导致动力学玻璃化转变时的约化堆积分数低于硬球。本工作为后续研究通常在实验和模拟中采用的硬磁盘二元或多分散混合物的玻璃化转变奠定了基础,以避免结晶,进而研究二维玻璃态胶体系统的流变学和力学响应。