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MATLAB自编程系列（1）---角分布函数
2022-07-25 07:13:00 【阿磊的MD记录簿】
MATLAB自编程系列（1）---角分布函数
键角分布函数作为一种重要的结构表征方法，在微观研究方法中成为确定物质结构演化规律以及拓扑结构状态的重要手段。虽然现有分子动力学后处理软件及程序包大都有键角分布函数计算的功能，但ADF的计算依旧存在一些问题，主要表现在：（1）操作简单的软件功能有限，不能满足需求；（2）部分软件ADF计算非常不准确；（3）能实现特点结构计算的程序包使用起来复杂，大都需要pyth
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