[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
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20110918/5b68228f/attachment.html>


More information about the users mailing list