'vc-relax', not 'vc_relax' P. On Thu, 2014-03-27 at 07:28 -0700, David Foster wrote: > Dear Users, > I have relaxed a bulk of Pd with "calculation=relax", but I get error when I > change it with > > "calculation=vc-relax". I added the card needed to the input. I have attached > input and > > its output containing the error. > > It will be appreciated if anyone help. > > > Regards > > David Foster > > Ph.D. Student of Chemistry > _______________________________________________ Pw_forum mailing list > Pw_forum at pwscf.org http://pwscf.org/mailman/listinfo/pw_forum
-- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
