Yiming Liu1, Qichang Fan1, Yuanyuan Zheng1

  • 1School of Civil Engineering, Sun Yat-sen University and Southern Marine Science and Engineering Guangdong Laboratory (Zhuhai), Zhuhai 519082, China.

概括

本研究介绍了一种快速,准确的分子动力学 (MD) 方法来计算矿物水接触角 (CA). 粘附工作受到表面基组和吸附的离子的影响,揭示了矿物质可湿性的关键因素.

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