[Pw_forum] error in reading namelist

[Paolo Giannozzi]

You need the mass per atom type, not per atom

P.

On Dec 27, 2012, at 16:34 , Mahdi Faghih nasiri wrote:

> Dear all,
> I am trying to run an ph calculation but the code complains:
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      from phq_readin : error #        19
>      reading inputph namelist
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
> I have checked input file but could not find anything wrong.:
>
>  /
>  &inputph
>   tr2_ph=1.0d-14,
>   ldisp=.true.,
>   nq1=4, nq2=4, nq3=1
>   amass(1)= 12.0107 ,
>   amass(2)= 12.0107 ,
>   amass(3)= 12.0107 ,
>   amass(4)= 12.0107 ,
>   amass(5)= 12.0107 ,
>   amass(6)= 12.0107 ,
>   amass(7)= 12.0107 ,
>   amass(8)= 12.0107 ,
>   amass(9)= 12.0107 ,
>   amass(10)= 12.0107 ,
>   amass(11)= 12.0107 ,
>   amass(12)= 12.0107 ,
>   outdir='/root/Desktop/QE/out/1',
>   fildyn='1.dyn',
>  /
>
>
>
> Mahdi Faghih nasiri
> MSC,
> Guilan University,
> Rasht, Iran.
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum

---
Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222