About PW91 XC

jjf_... at yahoo.com.cn jjf_... at yahoo.com.cn
Sun Oct 21 14:34:30 UTC 2012

Hi, evergyone, I am a newer about cp2k. I want to use PW91 functional to do 
some calculations. What keywords I should use in the XC_FUNCTIONAL? BTW, do 
you have any suggestions about the selections of potential and basis set 
when doing PW91 calculations.

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