[Pw_forum] Hybrid functionals for GIPAW calculations

Jarkko Vähäkangas Jarkko.Vahakangas at oulu.fi
Fri Jan 18 14:17:41 CET 2013


Thanks David for response. For now I´ll try to manage without HF exchange...

BR, Jarkko

> Dear Jarkko,
>     unfortunately this is not possible. Linear response with Hartree-Fock
> is not a piece of cake in QE.
> 
> Best wishes,
>     Davide
> 
> On 01/18/2013 10:21 AM, Jarkko Vähäkangas wrote:
>> Hi,
>> 
>> Is it possible in QE to use hybrid functionals for GIPAW calculations? If it is
>> where can I find such pseudo potentials?
>> 
>> thanks, Jarkko
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