论文标题
通过动力学特征,在排斥活性布朗颗粒的悬浮液中表征MIP的表征
Characterization of MIPS in a suspension of repulsive Active Brownian Particles through dynamical features
论文作者
论文摘要
二维活跃的布朗颗粒系统的目的是由硬盘组成,这些磁盘显示出排除的体积相互作用,通常使用纯抑制电位通过分子动力学进行模拟。我们表明,所选电势的柔软度在模拟的结果中起着作用,重点是运动诱导相位分离的情况。在没有径向扩散的纯硬球系统中,相图应完全取决于其密度和péclet数。但是,我们发现了影响ABP模型中的相图的两个附加效应:与推进项相比,截然扩散的相对强度和颗粒的重叠。如我们所示,如果我们使用的是,第二种效果可以强烈缓解,而不是标准的周几周 - 安德森的潜力,那是伪hard的潜力。此外,在确定相位空间的边界时,我们尝试了不同的方法来检测MIP,并得出结论,通过非高斯参数观察动态特征比观察结构的特征通过局部密度分布函数更有效。我们还证明了Vogel-Fulcher方程成功地再现了扩散的衰减,这是密度的函数,除了非常高密度的情况外。因此,在这方面,ABP系统的行为与脆弱的玻璃相似。
The two-dimensional Active Brownian Particles system is meant to be composed of hard disks, that show excluded volume interactions, usually simulated via molecular dynamics using pure repulsive potentials. We show that the softness of the chosen potential plays a role in the result of the simulation, focusing on the case of the emergence of Motility Induced Phase Separation. In a pure hard-sphere system with no traslational diffusion,the phase diagram should be completely determined by their density and Péclet number. However, we have found two additional effects that affect the phase diagram in the ABP model we simulate: the relative strength of the traslational diffusion compared to the propulsion term and the overlapping of the particles. As we show, the second effect can be strongly mitigated if we use, instead of the standard Weeks-Chandler- Andersen potential, a harder one, the pseudo-hard spheres potential. Moreover, in determining the boundary of our phase space, we have tried different approaches to detect MIPS and concluded that observing dynamical features, via the non-Gaussian parameter, is more efficient than observing structural ones, via the local density distribution function. We also demonstrate that the Vogel-Fulcher equation successfully reproduces the decay of the diffusion as a function of density, except for very high density cases. Thus, the ABP system behaves similarly to a fragile glass in this regard.