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Ye123

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4楼: Originally posted by identation at 2011-12-27 23:37:02
The calculations performed in this study were done using theCASTEP code based on DFT, using Vanderbilt-typeultra soft pseudopotentials and a plane-wave expansion of the wavefunctions. The self-consis ...

混迹小木虫第一性原理几个月,您一直是热心的大牛,真心佩服,不知现在还在浙大还是已经出国了?
11楼2012-12-17 16:49:57
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