[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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