On Jul 5, 2012, at 21:17 , Davide Tiana wrote: > I can't figure out why this input is wrong I can't figure out why you do not specify "what" is wrong 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