[QE-users] [SUSPECT ATTACHMENT REMOVED] Restart mode = 'restart' problems.

Paolo Giannozzi p.giannozzi at gmail.com
Mon Apr 5 17:00:57 CEST 2021


On Fri, Apr 2, 2021 at 6:43 PM Vasilios Passias <billy.passias at gmail.com>
wrote:

I thought of just using restart mode = 'from_scratch' instead for all my
> runs, which worked fine in the past. But, is there a way I could use
> restart mode = 'restart'  without having these problems?
>

restart_mode='restart' works only if the preceding run has been cleanly
stopped, either by setting a time limit (with variable max_seconds) or by
using the *.EXIT file. You may verify that restart works on a small, or not
so big, run.

Paolo


> The files for the restart mode = 'restart' run are attached.
>
> Thank you for your time and help on this matter.
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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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