[CP2K-user] [CP2K:13256] Re: convergence issue with diagonalisation

Hepsibahpriyadarshini C heps... at srmist.edu.in
Tue May 12 05:49:27 UTC 2020


Thank you
Regards
Hepsibah

On Thu, May 7, 2020 at 1:00 PM Fabian Ducry <fabia... at gmail.com> wrote:

> I would go with the newest version you can find for your system. cp2k 7.1
> can perform these calculations, 6.1 probably as well.
>
> Fabian
>
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