Thermal conductivity of hydrous wadsleyite determined by non-equilibrium molecular dynamics based on machine learning

This repository contains data used in "Thermal conductivity of hydrous wadsleyite determined by non-equilibrium molecular dynamics based on machine learning" submitted by Dong Wang, Zhongqing Wu and Xin Deng. Figure 1 : "MLP test-Energy" in Data for Figures.xlsx、MLP test-force.txt Figure 2 : "MLP test-NEMD" in Data for Figures.xlsx Figure 4 : "Modeing" in Data for Figures.xlsx

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