[Pw_forum] q2r.f90 error message "wrong nb read"

陳 少華 chen_shao_hua197 at yahoo.com.tw
Fri Jan 11 19:32:19 CET 2008


Dear Prof. Eyvaz Isaev,

Thanks for your advice. I will recalculate it
carefully.

max

--- Eyvaz Isaev <eyvaz_isaev at yahoo.com> 說:

> Hi,
> 
> It seems someting wrong in your dynamical matrix.
> Check carefully your input file (atomic positions
> and
> types) and dymanical matrices. The error happens
> when 
>  there is a mismatch between atomic types.
> 
> Bests,
> Eyvaz. 
> 
> 
> --- 陳 少華 <chen_shao_hua197 at yahoo.com.tw> wrote:
> 
> > Dear Forum's members,
> > 
> > There is a error message "wrong nb read" in the
> > In.q2r.out .
> > I check its meaning in q2r.f90 .
> > But I am not good at fortran's program.
> > Does anyone could tell me how to avoid this error
> ?
> > 
> > Thanks in advance
> > 
> > max
> > Physics department, National Taiwan
> > University,Taiwan 
> > 
> > P.S. In.q2r.in
> >  &input
> >   zasr='simple',  fildyn='In.dyn', flfrc='In.fc',
> > la2F=.true.
> >  /
> > 
> > 
> >      
> >
>
____________________________________________________________________________________
> >
>
免費下載迷你筆,中英翻譯輕鬆查!http://tw.mini.yahoo.com/
> > 
> > _______________________________________________
> > Pw_forum mailing list
> > Pw_forum at pwscf.org
> > http://www.democritos.it/mailman/listinfo/pw_forum
> > 
> 
> 
>
-------------------------------------------------------------------
> Prof. Eyvaz Isaev, 
> Theoretical Physics Department, Moscow State
> Institute of Steel & Alloys, Russia, and 
> Condensed Matter Theory Group, Uppsala University,
> Sweden 
> Eyvaz.Isaev at fysik.uu.se, eyvaz_isaev at yahoo.com
> 
> 
>      
>
____________________________________________________________________________________
> Looking for last minute shopping deals?  
> Find them fast with Yahoo! Search. 
>
http://tools.search.yahoo.com/newsearch/category.php?category=shopping
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
> 



      ____________________________________________________________________________________
免費下載迷你筆,中英翻譯輕鬆查!http://tw.mini.yahoo.com/




More information about the users mailing list