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cyx779

木虫 (小有名气)

hex

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[求助] MS导出的cell文件中原子坐标有4列，分别是什么意思

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1楼 2014-02-20 14:40:20

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卡开发发

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Ab Initio Amateur

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4列的东西，还是坐标，找了找，总觉得这个应该是是k-point和对应的权重，不知道对不对。。。

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2楼2014-02-20 22:29:41

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cyx779

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3楼2014-02-21 14:18:48

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