Molecular Dynamics simulations of spreading droplets

This dataset contains the results of non-equilibrium Molecular Dynamic simulations of 2-dimensional SPC/E water nanodroplets spontaneously spreading over silica-like walls, performed using Gromacs. The main purpose of these simulations is to study the motion of three-phases contact lines over high-friction surfaces and to test contact line friction models. Further details can be found in 'documentation.pdf'.本数据集包含采用Gromacs软件完成的二维SPC/E水纳米液滴在类二氧化硅壁面上自发铺展的非平衡分子动力学（non-equilibrium Molecular Dynamics）模拟结果。本系列模拟的核心目的为研究三相接触线（three-phase contact line）在高摩擦表面上的运动行为，并对接触线摩擦模型进行验证。更多详细信息可查阅“documentation.pdf”文件。