On Dec 18, 2010, at 4:38 , W2AGZ wrote: > what happened to nelec in namelist &system in 4.2.1? > From file Doc/release-notes:
Incompatible changes in version 4.2: [...] * nelec, nelup, neldw, multiplicity variables removed from input: use tot_charge and tot_magnetization instead So tot_charge is the variable to be used > To All, have a happy and joyous winter solstice break. > thank you! Here (Udine and Trieste) we just received the once-traditional snow delivery, in rather large amount Paolo --- Paolo Giannozzi, Dept of Chemistry&Physics, Univ. Udine via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
