[QE-users] Help

Hongyi Zhao hongyi.zhao at gmail.com
Mon Jan 10 10:28:34 CET 2022


On Mon, Jan 10, 2022 at 4:22 PM Lorenzo Paulatto <paulatz at gmail.com> wrote:

>  Dear Faezeh,
> The phonopy code is not a part of or affiliated with Quantum ESPRESSO, if
> I remember correctly they have a discussion page on github
>
> kind regards.
>
> --
> Lorenzo Paulatto
>
> [image: Sent from Mailspring]
> On Sat, Jan 1, 2022, 10:02 Faezeh Taravat <faezeh.taravat at email.kntu.ac.ir>
> wrote:
>
> Hello Dear.
> I am a beginner user of Quantum Espresso and I want to get the entropy and
> zero point energy using QHA code. For this purpose, I have done scf and
> PHONONY calculations. I don't know how to use QHA code. Can you help me in
> the rest of the way?
>
>
By saying QHA code, do you mean the following one:

https://github.com/MineralsCloud/qha

HZ
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