论文标题
活性布朗球体的相图:结晶和运动诱导的相分离
Phase Diagram of Active Brownian Spheres: Crystallization and the Metastability of Motility-Induced Phase Separation
论文作者
论文摘要
运动诱导的相位分离(MIP)是纯粹排斥的活性颗粒经历液态气相分离的现象,是最简单,最广泛研究的非平衡相变过的实例之一。在这里,我们表明,MIPS共存状态实际上仅在非常广泛的条件下三维活性的布朗颗粒中具有亚抗性,这在长时间通过订购过渡衰减,我们称为活动结晶。在MIPS临界点上方的活性下,液态气体双座被晶体流体共存曲线所取代,固体,液体和气体在两条曲线相交的三个点处共存。然而,从无序流体中成核的活性晶体需要罕见的波动,表现出近相的几乎封闭的密度。相应的结晶屏障仅在可行的时间表上仅在高活动范围内,并且仅在最大填料附近的流体密度下。活跃力量强烈减轻了这种均衡液体的玻璃感,因此液体总和共存的寿命随着活性的增加而稳步下降,在极高的活性下,模拟表现为一种轻松的自发结晶。
Motility-induced phase separation (MIPS), the phenomenon in which purely repulsive active particles undergo a liquid-gas phase separation, is among the simplest and most widely studied examples of a nonequilibrium phase transition. Here, we show that states of MIPS coexistence are in fact only metastable for three-dimensional active Brownian particles over a very broad range of conditions, decaying at long times through an ordering transition we call active crystallization. At an activity just above the MIPS critical point, the liquid-gas binodal is superseded by the crystal-fluid coexistence curve, with solid, liquid, and gas all coexisting at the triple point where the two curves intersect. Nucleating an active crystal from a disordered fluid, however, requires a rare fluctuation that exhibits the nearly close-packed density of the solid phase. The corresponding barrier to crystallization is surmountable on a feasible timescale only at high activity, and only at fluid densities near maximal packing. The glassiness expected for such dense liquids at equilibrium is strongly mitigated by active forces, so that the lifetime of liquid-gas coexistence declines steadily with increasing activity, manifesting in simulations as a facile spontaneous crystallization at extremely high activity.