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Updated: Jun 16, 2025

Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
06:37

Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package

Published on: September 17, 2021

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在使用蒙特卡洛模拟的反应扩散系统中计算宏观反应速率

Mohamed Swailem1, Uwe C Täuber1,2

  • 1Department of Physics &amp; Center for Soft Matter and Biological Physics, MC 0435, Robeson Hall, 850 West Campus Drive, <a href="https://ror.org/02smfhw86">Virginia Tech</a>, Blacksburg, Virginia 24061, USA.

Physical review. E
|August 20, 2024
PubMed
概括

本研究介绍了一种使用格子蒙特卡洛模拟的数值方法,用于在随机反应扩散系统中将微观概率映射到宏观反应速率. 这种方法有助于将模拟数据与实验观测相匹配,特别是在生态模型中.

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