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Peridynamic theory of solids from the perspective of-classical statistical mechanics

机译:古典统计力学视角下的固体周动力学理论

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In this paper the classical statistical mechanics has been explored in order to develop statistical mechanical framework for peridynamics. Peridynamic equation of motion is known as upscaled Newton's equation. The peridynamic system consists of finite number of nonlocally interacting particles at nano and meso scales. This particle representation of peridynamics can be treated in terms of classical statistical mechanics. Hence, in this work the phase space is constructed based on the PD particle from their evolving momentum pi and positions xi. The statistical ensembles are derived by defining appropriate partition functions. The algorithms for NVE and NPH implemented in the classical molecular dynamics are revisited for equilibrium peridynamic models. The current work introduces Langevin dynamics to the peridynamic theory through fluctuation dissipation principle. This introduces a heat bath to the peridynamic system which eliminates the ambiguity with the role of temperature in a peridynamic system. Finally, it was seen that the homogenization of a peridynamic model with finite number of particles approaches to a conventional continuum model. The upscaled non-equilibrium peridynamics has potential applications in modeling wide variety of multiscale multiphysics problems from nano to macro scale or vice versa. (C) 2015 Elsevier B.V. All rights reserved.
机译:在本文中,经典统计力学已经被探索,以便为周动力学发展统计力学框架。运动的周动力方程称为放大的牛顿方程。绕动力学系统由纳米和中等尺度的有限数量的非局部相互作用粒子组成。可以用经典的统计力学来处理这种围绕动力学的粒子表示。因此,在这项工作中,根据PD粒子的动量pi和位置xi构造了相空间。通过定义适当的分区函数可以得出统计集合。在平衡分子动力学模型中,对经典分子动力学中实现的NVE和NPH算法进行了重新讨论。当前的工作通过波动耗散原理将兰格文动力学引入到周动力学理论中。这将热浴引入到周边动力系统中,从而消除了温度在周边动力系统中的模糊性。最后,可以看到具有有限数量粒子的蠕动模型的均质化接近传统的连续体模型。高档化的非平衡周边动力学在建模从纳米级到宏观级的各种多尺度多物理场问题方面具有潜在的应用前景,反之亦然。 (C)2015 Elsevier B.V.保留所有权利。

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