[Wien] Fwd: email for support mailing list

[Peter Blaha]

You may have to adopt a few lines in the scripts or rename some scripts.

i) do you see a w2web-job file in your working dir with a proper content ?

ii) the unmodified qsub-wienjob_lapw contains

cp $WIENROOT/qsub-job0_lapw job2

but $WIENROOT/qsub-job0_lapw does not exist. Instead I have provided two 
crude templates
$WIENROOT/qsub-job0_ll  and  $WIENROOT/qsub-job0_sge

You have to copy them to qsub-job0_lapw and adapt them according to the 
needs of your queuing system.


Am 09.02.2012 18:03, schrieb Celine Hin:
> Dear WIEN2k users,
>
> We are trying to run w2web but we found the following problem:
>
> The w2web has been configured to use queuing system by editing the
> configuration and adding the line
>
> qsub=cat %f > w2web-job;qsub-wienjob_lapw
>
> When I try to execute the run using this execution type.
>
> I get the following display in the web interface
>
> "cd /home/celhin/WIEN2k/PbTe10;cat
> /home/celhin/WIEN2k/PbTe10/.command.471480.16886 > w2web-job;
> qsub-wienjob_lapw &
>
> But the above command is not executed, the w2web-job file is not created
> nor
> the qsub-wienjob_lapw script executed. I was wondering if anything else
> needs to be done to ensure that the above execution type can be used.
>
> Best regards,
> Celine Hin.
>
>
>
>
>
>
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-- 
Peter Blaha
Inst.Materials Chemistry
TU Vienna
Getreidemarkt 9
A-1060 Vienna
Austria
+43-1-5880115671