It was, in fact, very simple. I have fixed it. I add few more options in vcsmd.f90. It is now ok.
On Thu, Jul 26, 2012 at 9:22 PM, Paolo Giannozzi <giannozz at democritos.it>wrote: > > On Jul 26, 2012, at 9:39 , Ranber Thakur wrote: > > > VC-md calculations does not stop after nstep. It keep running > > forever. What does this mean? Is there some strange bug? > > sort of. More exactly: nobody has ever cared about this. > It will likely be fixed whenever a long-overdue cleanup of > the molecular dynamics code will be done > > P. > --- > Paolo Giannozzi, Dept of Chemistry&Physics&Environment, > Univ. Udine, via delle Scienze 208, 33100 Udine, Italy > Phone +39-0432-558216, fax +39-0432-558222 > > > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20120726/c2cf1f84/attachment-0001.htm
