HSE

Run-time issues concerning Yambo that are not covered in the above forums.

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HSE

Postby vitoversace » Wed Jun 04, 2014 5:35 pm

Dear Daniele,

Can Yambo not handle HSE functional ?

When running P2Y -S -N i see no line quoting that yambo uses HSE as it is always the case for other functional types !!!
And finally the results of quasi particles are very wrong when i keep going with gw calculation based on HSE functional from QE !!!

Bests
Vito
Vito Versace
PhD student
University of York
vitoversace@yahoo.com
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Re: HSE

Postby Daniele Varsano » Wed Jun 04, 2014 5:53 pm

Dear Vito,
Unfortunately yambo does not handle hybrid functionals yet.
We are working on that, and hopefully this feature will be available soon, with the next release of the code, but I cannot say exactly when.

Best,
Daniele
Dr. Daniele Varsano
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
http://www.nano.cnr.it
http://www.max-centre.eu/
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