On Apr 16, 2012, at 22:05 , Giuseppe Mattioli wrote: > Is it possible to make the neb.x wrapper able to "pass the -ndiag > option" to the pw.x engine? doesn't it work? neb.x -ndiag N ... 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