Also, be carefull, plumed was not patched properly with the automatic "make plumed " for 5.0 and 5.0.1. Download espresso-5.0.2 with the new plumed version.
cheers Layla 2012/12/6 Axel Kohlmeyer <akohlmey at gmail.com> > On Thu, Dec 6, 2012 at 6:21 PM, Paolo Giannozzi <giannozz at democritos.it> > wrote: > > > > On Dec 6, 2012, at 16:58 , ruchir behal wrote: > > > >> hills.c(271): error: identifier "BOLTZ" is undefined > >> this_ww = hills.wwr*exp(-hills.Vhills/(BOLTZ* > >> (colvar.wfactor-1.0)*colvar.simtemp)); > > > > there is no "hills.c" FILE in QE > > unless you do: make plumed > > :-) > > axel. > > > > > > > > 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://pwscf.org/mailman/listinfo/pw_forum > > > > -- > Dr. Axel Kohlmeyer akohlmey at gmail.com http://goo.gl/1wk0 > International Centre for Theoretical Physics, Trieste. Italy. > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum > -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121206/c01a8aae/attachment.html
