Re-entrant percolation in active Brownian hard disks

被引:1
|
作者
Evans, David [1 ]
Martin-Roca, Jose [2 ,3 ]
Harmer, Nathan J. [1 ,4 ]
Valeriani, Chantal [2 ,3 ]
Miller, Mark A. [1 ]
机构
[1] Univ Durham, Dept Chem, South Rd, Durham DH1 3LE, England
[2] Univ Complutense Madrid, Dept Estruct Mat Fis Term & Elect, Madrid 28040, Spain
[3] Grp Interdisciplinar Sistemas Complejos, Madrid, Spain
[4] West Cambridge Site, Dept Chem Engn & Biotechnol, Philippa Fawcett Dr, Cambridge CB3 0AS, England
基金
英国工程与自然科学研究理事会; 欧盟地平线“2020”;
关键词
EQUATION-OF-STATE; CONTINUUM PERCOLATION; PHASE-BEHAVIOR; PARTICLES; AGGREGATION; THRESHOLD; SYSTEM;
D O I
10.1039/d4sm00975d
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Non-equilibrium clustering and percolation are investigated in an archetypal model of two-dimensional active matter using dynamic simulations of self-propelled Brownian repulsive particles. We concentrate on the single-phase region up to moderate levels of activity, before motility-induced phase separation (MIPS) sets in. Weak activity promotes cluster formation and lowers the percolation threshold. However, driving the system further out of equilibrium partly reverses this effect, resulting in a minimum in the critical density for the formation of system-spanning clusters and introducing re-entrant percolation as a function of activity in the pre-MIPS regime. This non-monotonic behaviour arises from competition between activity-induced effective attraction (which eventually leads to MIPS) and activity-driven cluster breakup. Using an adapted iterative Boltzmann inversion method, we derive effective potentials to map weakly active cases onto a passive (equilibrium) model with conservative attraction, which can be characterised by Monte Carlo simulations. While the active and passive systems have practically identical radial distribution functions, we find decisive differences in higher-order structural correlations, to which the percolation threshold is highly sensitive. For sufficiently strong activity, no passive pairwise potential can reproduce the radial distribution function of the active system. Weak activity in active Brownian particles enhances percolation but stronger motility breaks up the clusters. Effective pairwise potentials accurately reproduce the radial distribution functions but the active system has higher-order correlations.
引用
收藏
页码:7484 / 7492
页数:9
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