[Pw_forum] d3 errors in file reading

[matthieu verstraete]

Brilliant, thanks Paolo. The parallel executable with the added
input_from_file appears to be working. For the moment with 1 processor
- is d3 fully parallelized? Can I run it with more?

The davcio error was for the sequential executable, which is either
incompatible with the parallel generated files, or just buggy.

Ciao

Matthieu

On Sat, Sep 25, 2010 at 4:11 PM, Paolo Giannozzi <giannozz at democritos.it> wrote:
>
> On Sep 25, 2010, at 2:49 , matthieu verstraete wrote:
>
>> http://www.democritos.it/pipermail/pw_forum/2003-June/000339.html
>
> that was 7 years ago!
>
>> pw.x and ph.x have no problems with the -inp directives. Don't know
>> why d3 does.
>
> oh well. Because support for -inp it is not there. Quick-and dirty
> fix: in D3/d3_readin.f90,
> add
>
>      CALL input_from_file ( )
>
> between
>
>   IF ( ionode ) THEN
>
> and
>      !
>      !    Read the first line of the input file
>      !
>      READ (5, '(a)', err = 100, iostat = ios) title
>
> Before starting an enquiry on the "davcio error" (seomthing that
> should never happen)
> It would be useful to know whether the problem shows up on other
> machines as well
>
> 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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-- 
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Prof. Matthieu Verstraete

Universite de Liège
Institut de Physique, Bat. B5, 3/7
Allée du 6 aout, 17
B- 4000 Sart Tilman, Liège
Belgium

Associate member European Theoretical Spectroscopy Facility (ETSF
http://www.etsf.eu)

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Fax   : +32 4 366 36 29

Mail : matthieu.verstraete at ulg.ac.be
          matthieu.jean.verstraete at gmail.com