On Sep 11, 2009, at 14:24 , Stefano de Gironcoli wrote: > It should be fixed or even better, removed, since there are alternative and simpler methods to specify occupancies P. --- Paolo Giannozzi, Dept of Physics, University of Udine via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222