[Pw_forum] hybrid band structure calculation

Paolo Giannozzi paolo.giannozzi at uniud.it
Wed Jun 19 22:47:28 CEST 2013

On Mon, 2013-06-17 at 16:16 +0100, Davide Tiana wrote:

> thanks for answering. So, if I correctly understood 
> I can't run a hybrid band structure from Gamma to X?

I don't think you can, unless you happen to have a uniform
grid along Gamma-X

> is there a particular reason for this limitation or is just cause  
> hybrid functional has just been implemented inside of QE?

the latter you say, I think

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

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