[Pw_forum] (no subject)

dario rocca roccad at gmail.com
Tue Aug 4 17:24:51 CEST 2015


Hello,
first of all is the variable Q_ESP_DIR properly set up during the run? It
doesn't seem that that is the case....
Just give the explict path to the pseudopotential
Best,
Dario Rocca

On Tue, Aug 4, 2015 at 4:56 PM, mohammed shambakey <shambakey1 at gmail.com>
wrote:

> Hi
>
> I trying to run the following command
>
> mpirun -np 8 pw.x < ./6x6-6+6H+F.scf.in > ./results/6x6-6+6H+F.scf.out
>
> but it fails due to missing file /C.pz-vbc.UPF. The file is downloaded and
> accessible in "pseudo" folder, but still have the same error.
>
> Please help
>
> Attached is the "CRASH" and "6x6-6+6H+F.scf.out" files
>
> --
> Mohammed
>
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