[Pw_forum] from frc_blk : error #

Sanjeev Gupta physics.skgupta at gmail.com
Thu Aug 2 08:40:41 CEST 2012


Dear PWSCF user
Greetings



*For Phonon calculation:*
After successfully running q2r.in. But matdyn.in running
&input
     amass(1)=65.409,
    amass(2)=15.9994,
    asr='crystal',
    flfrc='zno.fc',
    flfrq='zno.freq'
/
...............
.............

I am getting this error like this

 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     task #         0
     from frc_blk : error #         1
     wrong total_weight
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

Please suggest me.
Best Regards
Sanjeev





-- 
*Dr. Sanjeev Kumar Gupta*
*Post Doctoral Fellow,
(Ministry of New and Renewable Energy)
Department of Physics,
Bhavnagar University, Bhavnagar-364 022
Gujarat, India*
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