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arXiv 1607.03285cond-mat.stat-mech
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光滑耗散粒子动力学中的尺寸一致性

Size consistency in Smoothed Dissipative Particle Dynamics

G. Faure, J. Roussel, J. -B. Maillet, G. Stoltz

摘要:

光滑耗散粒子动力学(SDPD)是一种介观方法,允许选择模拟流体的分辨率水平。在这项工作中,我们研究的一致性所产生的热力学性质作为一个功能的mesoparticles的大小,无论是在平衡和平衡。我们还提出了一个重新制定的SDPD方程的能量变量。这增加了与具有能量守恒的耗散粒子动力学的相似性,并为两种方法之间的耦合开辟了道路。最后,我们提出了一个数值方案SDPD,确保守恒的动力学不变量。数值模拟说明了这种方法。

英文摘要:

Smoothed Dissipative Particle Dynamics (SDPD) is a mesoscopic method which allows to select the level of resolution at which a fluid is simulated. In this work, we study the consistency of the resulting thermodynamic properties as a function of the size of the mesoparticles, both at equilibrium and out of equilibrium. We also propose a reformulation of the SDPD equations in terms of energy variables. This increases the similarities with Dissipative Particle Dynamics with Energy conservation and opens the way for a coupling between the two methods. Finally, we present a numerical scheme for SDPD that ensures the conservation of the invariants of the dynamics. Numerical simulations illustrate this approach.

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