[Pw_forum] Error running pwcond example
Paolo Giannozzi
p.giannozzi at gmail.com
Mon Apr 25 21:36:01 CEST 2016
I think it is sufficient to remove the redirection of /dev/null in routine
PWCOND/src/print_clock_pwcond.f90, recompile. The redirection is done
anyway, in a windows-aware more, at startup
Paolo
On Mon, Apr 25, 2016 at 7:23 PM, Axel Kohlmeyer <akohlmey at gmail.com> wrote:
>
>
> On Mon, Apr 25, 2016 at 1:13 PM, Ravish Jamnal <ravishjamnal22 at gmail.com>
> wrote:
>
>> Hi All,
>>
>> I am new to quantum espresso and wanted to learn how to use the pwcond
>> package. So to start working with it I tried to run the examples given
>> on Alexandre Smogunov's home page. I ran the lead.in file for the
>> example 'Perfect monatomic Al wire without any scatterer (a test case)' and
>> it completed successfully giving me the lead.out file. But I am confused
>> about the cond.in file. When I ran it, I got a cond.out file and also
>> a trans.alwire file but I also got an error message on the command window
>> of which I have attached a screenshot. So, I want to know how can I remove
>> this error?
>>
>
> you will have to teach the pwcond software that there is no /dev/null
> file on windows and either implement a less sloppy way to turn off output
> for MPI ranks != 0 or implement the equivalent for windows (which should be
> "nul:", IIRC).
>
> axel.
>
>
>
>>
>> Best Regards,
>> Ravish
>>
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>> Pw_forum at pwscf.org
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>>
>
>
>
> --
> Dr. Axel Kohlmeyer akohlmey at gmail.com http://goo.gl/1wk0
> College of Science & Technology, Temple University, Philadelphia PA, USA
> International Centre for Theoretical Physics, Trieste. Italy.
>
> _______________________________________________
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>
--
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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