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Application of event-driven molecular dynamics approach to rarefied gas dynamics problems

机译:事件驱动的分子动力学方法在稀释气体动力学问题中的应用

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摘要

The numerical method based on event-driven molecular dynamics (EDMD) algorithm was developed for investigation of free-molecular and transitional gas flows in regions with arbitrary boundaries. Method was applied to two classical problems of rarefied gas dynamics: (1) transitional gas flow through plane channel of finite length between two reservoirs with small pressure difference, (2) supersonic flow past cylinder. These very different problems were chosen in order to study efficiency and applicability limits of the EDMD method for rarefied gas dynamics. The importance of the EDMD approach for rarefied gas dynamics is that EDMD is fully deterministic meshless implementation of chosen collision model without stochastic collision pair selection (unlike direct simulation Monte-Carlo method) or simplification of the collision integral (unlike model equations methods). So it gives additional information for the analysis of mechanical model itself with no regard to the features of the algorithm and can be used for verification of other numerical methods. (C) 2018 Elsevier Ltd. All rights reserved.
机译:基于事件驱动的分子动力学(EDMD)算法的数值方法开发用于对具有任意边界的区域中的自由分子和过渡气体流动的研究。将方法应用于稀有气体动力学的两个经典问题:(1)过渡气流通过平面通道的平面通道,其中两个储存器之间的有限长度,具有小的压力差,(2)超声波流过去圆柱体。选择了这些非常不同的问题,以便研究稀土气体动力学的EDMD方法的效率和适用性限制。 EDMD方法对稀土气体动力学的重要性是EDMD在没有随机碰撞对的选择(与直接仿真Monte-Carlo方法不同)或碰撞积分的简化(与模型方程)的简化中进行完全确定的碰撞模型(与模型方程式方法不同)进行完全确定的碰撞模型因此,它为机械模型本身提供了额外的信息,对于算法的特征而言,可以用于验证其他数值方法。 (c)2018年elestvier有限公司保留所有权利。

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