[QE-users] pseudopotentials implemented in epsilon.x

[Lorenzo Paulatto]

I think only norm conserving pseudopotentials, any kinf of functional.

kind regards
--
Lorenzo Paulatto - Paris
On Aug 26 2021, at 4:12 pm, patrizio.graziosi at cnr.it wrote:
>
> Hello everybody,
> I run an electronic structure calculation using relativistic USPP,
> qe-6.8, after that I run epsilon.x and got the error message that USPP
> are not implemented. However, in the epsilon.x user manual I am not
> able to find which pseudopotentials are implemented, which I'd like to
> know before re-run the calculation.
>
> Here's the question, does someone know which pseudopotentials are
> implemented in epsilon.x?
>
> I guess from here
> https://www.paradim.org/sites/default/files/2019-05/Band_Structure_and_UV-VIS_Spectra.pdf
> that PZ are supported, but they are not available for all the atomic
> species I'm interested in...
>
> Thanks in advance,
> Patrizio
>
>
>
>
>
>
>
>
>
>
>
>
>
>
> --
> Patrizio Graziosi, PhD
> Research Scientist
> CNR - ISMN
> Institute for the Study of Nanostructured Materials
>
> _______________________________________________
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing list users at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
>

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20210826/5aabff8c/attachment.html>