DFT,密度泛函理论+第一性原理计算+过渡态+活化能计算+吸附能+MS运行脚本

上传者: 52672749 | 上传时间: 2022-11-30 12:02:41 | 文件大小: 13.79MB | 文件类型: ZIP
适用于研究生,材料领域,科研,涉及密度泛函理论,第一性原理计算,MS脚本,简单方便

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