[Pw_forum] From davcio: error #10

Patrick Holvey pholvey at gmail.com
Sun Mar 7 22:29:11 CET 2010


Paolo (and everyone else),

Thanks for the quick reply.  Just a few questions.  If the error in davcio
results solely from a bad outdir, why did the error resolve itself in my
original input file when I changed the celldms to correspond with Linh's
suggestions?  Further, since the runs worked on 3 of the 25 submitted input
files, doesn't that show that there is no error in writing to the
destination?  The only reason I ask is that I'm almost completely positive
that I'm not running into disk limitations (although I will check for sure
on monday), and if that's not the issue, then I need to hammer out what is
really causing this.

 Thanks again,

Patrick
University of Notre Dame

On Sun, Mar 7, 2010 at 6:19 AM, Paolo Giannozzi <giannozz at democritos.it>wrote:

> Patrick,
>
> there is nothing wrong in your data (or, more exactly, nothing
> obviously wrong). In any event, nothing in your data can cause
> an "error in davcio", apart from a bad value of "outdir". See here:
>  http://www.quantum-espresso.org/user_guide/node46.html
> and here for parallel execution, in sec.3.3.1:
>  http://www.quantum-espresso.org/user_guide/node17.html .
>
> I run one of your data file and everything seems ok. You may want to
> try to find optimal values of  -npool and -ndiag to achieve maximum
> speed, but this has nothing to do with your problem, which is related
> uniquely to the place where you are trying to write files.
>
> P.
>
>
>
>
> ---
> Paolo Giannozzi, Dept of Physics, University of Udine
> via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
>
>
>
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>


-- 
Patrick Holvey
pholvey at nd.edu
442 Siegfried Hall
Notre Dame, IN 46556
Cell: (865)-659-9908
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