[QE-developers] Fwd: Error in relax calculation

Paolo Giannozzi p.giannozzi at gmail.com
Wed Apr 27 22:13:32 CEST 2022


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Paolo

On Wed, Apr 27, 2022 at 10:01 PM imane BEZZAOUI <imane.bezzaoui at ump.ac.ma>
wrote:

>
>
> Dear QE developers,
>
>
>
> I want to do relax calculation with 80 atoms just only the z component but
> the calculation stopped in
>
>  Waiting for input...
>
>      Reading input from standard input
>
> Warning: card &CELL ignored
>
>
>
> I do my calculation in the cluster  HPC QE v 6.8
>
>  Best regards
> ________________________________________________
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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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