活跃粒子系统的场论及其熵的产生。

IF 20.7
Gunnar Pruessner, Rosalba Garcia-Millan
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引用次数: 0

摘要

将化学能转化为自我推进的活性粒子可以保持远离平衡的稳定状态并做功。熵产测量的是这样一个粒子系统离平衡状态有多远,并作为所做功的代理。场论为计算熵产生提供了一条很有前途的途径,因为它允许同时考虑许多相互作用的粒子。利用加性噪声的粗粒化或平滑获得的近似场论可以很好地捕获密度和相关性,但它们通常忽略了组成部分的微观粒子性质,从而产生虚假的熵产生结果。作为一种替代方案,我们演示了如何使用Doi-Peliti场论,它捕捉了微观动力学,包括与外部和对势的反应和相互作用。这种场论在原理上是精确的,同时以图解的形式提供了一种系统的近似方案。我们演示了如何从福克-普朗克方程(FPE)构建它们,并展示了如何从第一性原理计算活性物质的熵产。我们的新方法相当于一种范式转变,即从微观动力学中精确计算熵产率,而不是从不受控制的近似中的粗粒度描述中推导熵产率。这个框架很容易扩展到包括交互。我们用它来推导出广泛的相互作用的守恒粒子系统的熵产生的精确、紧凑和有效的一般表达式。这些表达式独立于基础场论,可以解释为局部熵产生的空间平均。它们很容易适用于数值和实验数据。一般来说,由于任何对相互作用产生的熵最多在三个点上,相等的时间密度;和(2n-1)点密度上的n点相互作用。我们用一些精确的、易于处理的例子来说明这种新技术,包括一些具有对相互作用的例子,以及许多相互作用的活跃布朗粒子的系统。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Field theories of active particle systems and their entropy production.

Active particles that translate chemical energy into self-propulsion can maintain a far-from-equilibrium steady state and perform work. The entropy production measures how far from equilibrium such a particle system operates and serves as a proxy for the work performed. Field theory offers a promising route to calculating entropy production, as it allows for many interacting particles to be considered simultaneously. Approximate field theories obtained by coarse-graining or smoothing that draw on additive noise can capture densities and correlations well, but they generally ignore the microscopic particle nature of the constituents, thereby producing spurious results for the entropy production. As an alternative we demonstrate how to use Doi-Peliti field theories, which capture the microscopic dynamics, including reactions and interactions with external and pair potentials. Such field theories are in principle exact, while offering a systematic approximation scheme, in the form of diagrammatics. We demonstrate how to construct them from a Fokker-Planck equation and show how to calculate entropy production of active matter from first principles. This framework is easily extended to include interaction. We use it to derive exact, compact and efficient general expressions for the entropy production for a vast range of interacting conserved particle systems. These expressions are independent of the underlying field theory and can be interpreted as the spatial average of thelocalentropy production. They are readily applicable to numerical and experimental data. In general, the entropy production due to any pair interaction draws at most on the three point, equal time density; and ann-point interaction on the(2n-1)-point density. We illustrate the technique in a number of exact, tractable examples, including some with pair-interaction as well as in a system of many interacting Active Brownian Particles.

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