[Pw_forum] phonon dispersion for graphene
Elie Moujaes
elie.moujaes at hotmail.co.uk
Wed Mar 31 22:46:06 CEST 2010
Dear Prof. Gianozzi and all,
Actually the "&" was there but I missed it when i copied the file. The missing title was the problem. This is sorted but when I started running the ph.x I got another error:
Atomic displacements:
There are 6 irreducible representations
Representation 1 1 modes -A To be done
Representation 2 1 modes -A To be done
Representation 3 1 modes -A To be done
Representation 4 1 modes -A To be done
Representation 5 1 modes - To be done
Representation 6 1 modes - To be done
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from davcio : error # 20
error while reading from file
Well, I found that some people on the forum have got such an error but with I/O error than "reading from file". The error probably means that something was wrong while reading the previous file...I ran a scf calculation (pw.x) followed by the ph.x. I would appreciate it if you can suggest how to fic this problem..I repeated the calculations several times but in vain..
Regards
> From: giannozz at democritos.it
> Date: Wed, 31 Mar 2010 21:30:58 +0200
> To: pw_forum at pwscf.org
> Subject: Re: [Pw_forum] phonon dispersion for graphene
>
>
> On Mar 31, 2010, at 21:26 , Elie Moujaes wrote:
>
> > reading inputph namelist
>
> if the code says that your namelist is wrong: it is wrong.
>
> > inputph
>
> Missing: a title line; a & before inputph
> ---
> Paolo Giannozzi, Dept of Physics, University of Udine
> via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
>
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
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