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Updated: Jul 11, 2025

An Analog Macroscopic Technique for Studying Molecular Hydrodynamic Processes in Dense Gases and Liquids
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An Analog Macroscopic Technique for Studying Molecular Hydrodynamic Processes in Dense Gases and Liquids

Published on: December 4, 2017

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液体粗粒度相互作用的高斯表示:理论,参数化和可转移性

Jaehyeok Jin1,2, Jisung Hwang3, Gregory A Voth1

  • 1Department of Chemistry, Chicago Center for Theoretical Chemistry, James Franck Institute, and Institute for Biophysical Dynamics, The University of Chicago, 5735 S. Ellis Ave., Chicago, Illinois 60637, USA.

The Journal of chemical physics
|November 9, 2023
PubMed
概括

我们为粗粒度 (CG) 模型开发了一种新方法,提高了它们的准确性和可转移性. 这种方法使用高斯函数和扰动理论来创建更可扩展的液体CG模型.

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