[Pw_forum] GIPAW in QE 5.0.2

[Davide Ceresoli]

Dear Roberta,
     there is qe-gipaw-5.0.3 prepared for the last Cecam tutorial in Zurich.
Here is the link:
https://drive.google.com/folderview?id=0BxmE1NC-2O4wRXVmeXJFdHUwZDg&usp=sharing

It can't handle metals yet. I'm working on it but I've got weird results
depending on the smearing scheme (gaussian vs cold vs fermi-dirac).

Best,
     Davide


On 04/10/2014 01:07 PM, roberta wrote:
> Dear all,
> does a qe-gipaw implementation exist for quantumEspresso 5.0.2 (corrected to
> 5.0.3 through espresso-5.0.2-5.0.3.diff)? If so, can it handle with metallic
> systems?
> Best regards,
> Roberta
> PhD student - University of Cambridge