[Pw_forum] dynmat.x error 1
Tiju Thomas
tijuthomas at jncasr.ac.in
Wed Aug 9 12:16:22 CEST 2006
Dear pw users,
Greetings to all
The following is the input file I set up for dynmat.x
&input
fildyn='SiCprim.dynG1',
amass(1)= 28.0855,
amass(2)=12.000 ,
asr= 'crystal',
filout='SiCprim.out',
filxsf= 'SiCprim.axsf',
/
and the dynamical matrix SiCprim.dynG1 seems to be generated correctly,
but in the output file I get the following:-
Reading Dynamical Matrix from file SiCprim.dynG1
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from latgen : error # 1
wrong at for ibrav=0
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
:-
Everything was running without any ibrav complaint so far, I do'nt know
why the code is complaing now, please help as soon as possible,
Thanking you in anticipation
Regards
Tiju Thomas
MS (Engg)
Theoretical Sciences Unit
JNCASR, Bangalore, India
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