On Jul 10, 2008, at 7:33 , Mansoureh Pashangpour wrote: > why total energy with scf run and CP run are different?
because one is in Ry and one in Ha? --- Paolo Giannozzi, Dept of Physics, University of Udine via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
