Dataset for the article "Atom-centered electric multipole moments dynamically generated from QM/MM MD simulations"
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下载链接：
https://zenodo.org/doi/10.5281/zenodo.17521584
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资源简介：
This dataset contains additional material related to the article "Atom-centered electric multipole moments dynamically generated from QM/MM MD simulations". For each system studied, the corresponding folder contains the Jupyter notebook with the analysis scripts to reproduce the plots in the article.
提供机构：
Zenodo
创建时间：
2025-11-04
