[Pw_forum] Pseudo potentials for hybrid DFT

Paolo Giannozzi giannozz at democritos.it
Mon Apr 18 18:36:42 CEST 2011


On Apr 18, 2011, at 18:25 , Eyvaz Isaev wrote:

>  Variable:       input_dft
>  [...]
> But as far as I remember this works (at least, worked) for norm- 
> conserving pseudopotentials only.

just a remark: hybrid functionals work only for norm-conserving  
pseudopotentials,
but variable input_dft works in all cases

Paolo
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Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222






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