Data for: "What is the Optimal Dipole Moment for Non-Polarizable Models of Liquids?"
收藏DataCite Commons2023-02-17 更新2025-04-17 收录
下载链接：
https://pureportal.strath.ac.uk/en/datasets/7e19e6b9-1bae-4928-bed8-5c8d29310c7c
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资源简介：
This data set includes all input files for molecular dynamics (MD) simulations carried out for the above article. The data is organised into two sections, mirroring the paper: 1) QUBE simulations, including Force Balance parameter optimisation; 2) PolCA simulations.
提供机构：
University of Strathclyde
创建时间：
2023-02-17
