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Updated: Jun 11, 2025

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Published on: April 12, 2019

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糖醇水性混合物的结构和动力学:从分子动力学模拟的见解

Martina Požar1, Bernarda Lovrinčević1

  • 1University of Split, Faculty of Science, Ru era Boškovića 33, 21000 Split, Croatia. bernarda@pmfst.hr.

Soft matter
|October 1, 2024
PubMed
概括

分子动力学模拟显示,水性糖醇混合物形成了一个强大的结网络. 增加甘油度会加强相关性,并减缓水和甘油分子的扩散.

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