[QE-users] neb: convergence achieved in *** iterations

Paolo Giannozzi p.giannozzi at gmail.com
Thu Jun 10 08:32:01 CEST 2021


I think that 999 steps should be more than enough to reach convergence ... !

On Fri, Jun 4, 2021 at 3:00 PM Mauro Sgroi <maurofrancesco.sgroi at gmail.com>
wrote:

> Dear developers,
> just to report that probably the format string for the message in the
> object has to be modified to print correctly the number of neb steps for
> values higher than 999.
>
> Best regards,
> Mauro.
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-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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