[QE-users] How to use SCAN functional

Claudio A. Perottoni caperott at gmail.com
Fri Jan 17 17:19:34 CET 2020


Dear Valentina,

Maybe you can find some useful information in a previous thread on
rvv10+scan calculations at
https://lists.quantum-espresso.org/pipermail/users/2019-June/042912.html

Regards,
Claudio


On Fri, Jan 17, 2020 at 11:23 AM Valentina Cantatore <valcan at chalmers.se>
wrote:

> Dear Quantum Espresso people,
>
>
>
> For some reasons I would like to start calculation using SCAN functional
> on Hg Cuprates.
>
> Can someone give me a hint on where to start, which libraries to use and,
> mostly, if it is possible to run such calculations?
>
>
>
> Thank you very much for your support.
>
>
>
> Best regards,
>
> Valentina Cantatore
>
> Chalmers University of Technology, Göteborg, Sweden
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-- 

*Claudio A. Perottoni*

Universidade de Caxias do Sul
95070-560 Caxias do Sul - RS - Brazil
http://www.researcherid.com/rid/B-8409-2008
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