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michal_li

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[求助] 分子模拟径向分布函数的做法

我用的是Mdynamix4.3版本的,请问径向分布函数怎么样定义一个原子和另外好几个原子的RDF,比如我的体系有AlCl3和Cl-,我要做Al和Cl之间的RDF,怎么把四个Cl都定义,因为后面还要做配位数分析。
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