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Thermodynamically consistent lattice Monte Carlo method for active particles

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arxiv 2503.16958 v1 pith:S5CPV6GY submitted 2025-03-21 cond-mat.soft cond-mat.stat-mech

classification cond-mat.softcond-mat.stat-mech
keywords activedynamicsparticlescarloconsistentcontinuumlatticemethod
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abstract

Recent years have seen a growing interest in the thermodynamic cost of dissipative structures formed by active particles. Given the strong finite-size effects of such systems, it is essential to develop efficient numerical approaches that discretize both space and time while preserving the original dynamics and thermodynamics of active particles in the continuum limit. To address this challenge, we propose two thermodynamically consistent kinetic Monte Carlo methods for active lattice gases, both of which correctly reproduce the continuum dynamics. One method follows the conventional Kawasaki dynamics, while the other incorporates an extra state-dependent prefactor in the transition rate to more accurately capture the self-propulsion velocity. We find that the error scales linearly with time step size and that the state-dependent prefactor improves accuracy at high P\'{e}clet numbers by a factor of $\mathrm{Pe}^2$. Our results are supported by rigorous proof of convergence as well as extensive simulations.

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Cited by 2 Pith papers

Reviewed papers in the Pith corpus that reference this work. Sorted by Pith novelty score. Full citation record

  1. Quantifying dissipation in flocking dynamics: When tracking internal states matters

    cond-mat.stat-mech 2025-05 conditional novelty 6.0 of 10

    In a thermodynamically consistent flocking model, discarding internal-state dynamics severely underestimates dissipation in the disordered phase but not in the ordered polar phase.

  2. Thermodynamic Irreversibility in Underdamped Brownian Motion with Spatial Temperature Gradients

    cond-mat.stat-mech 2025-09 reject novelty 3.0 of 10

    The paper claims that for an underdamped Brownian particle in a spatial temperature gradient, entropy production and extraction rates vanish at zero force while their time-integrated totals stay finite, so a zero rate...

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