PMF Files (TIP4P/2005)
收藏Figshare2021-03-04 更新2026-04-28 收录
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https://figshare.com/articles/dataset/PMF_Files_TIP4P_2005_/14138057
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资源简介：
Contains files with data of PMF landscape at different temperatures and pressures. The file names indicate the temperature and pressure of the system.This folder contains data of TIP4P/2005 water model. The x column indicates the O--H distance (A), the y column contains the O-H-O angles (degrees) and the z column has the PMF values in kTThis item is a part of the collection “Data for scientific article- Potential of mean force based identification of strong and weak hydrogen bonds in liquid water”, https://doi.org/10.11583/dtu.c.5324957
创建时间：
2021-03-04
