[Pw_forum] error in relaxation
Paolo Giannozzi
giannozz at nest.sns.it
Mon Mar 24 19:02:00 CET 2008
On Monday 24 March 2008 04:36, madhura at jncasr.ac.in wrote:
> But may I know what was that bug about?
I think it is this one:
http://www.democritos.it:8888/O-sesame/chngview?cn=5643
http://www.democritos.it:8888/O-sesame/chngview?cn=5649
but I am not sure.
> Also just for one system if I use different version what about the
> numerical errors introduced? Can I compare the data without worrying about
> that/
numerical differences between different versions should not be
significant
Paolo
--
Paolo Giannozzi, Democritos and Udine University
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