[Pw_forum] from check_atoms : error # : Problem solved
ramesh kumar
raamesh123 at rediffmail.com
Sun Sep 18 19:12:48 CEST 2011
Dear All
Thankyou very much for all the replies. the problem about overlap of atoms is solved. That was a
input file mistake instead of crystal i used alat. And instead of elongate c axis i wrongly made
a axis to elongate thankyou for all the suggestions.
with regards
ramesh
With regards
K. Ramesh Kumar
Research Scholar
Department of Physics
IIT-Madras
Chennai-600 036
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