On Jun 17, 2010, at 4:54 , Weyl Fang wrote: > i can not find the spin multiplicity in QE-4.2. use "tot_magnetization" - P. --- Paolo Giannozzi, Dept of Physics, University of Udine via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222