On Mon, 2014-04-28 at 18:33 +0200, Tommaso Francese wrote: > occupations = 'tetrahedra' ,
tetrahedra are not in principle suitable for scf calculations ... > smearing = 'marzari-vanderbilt' ... and this option is incompaticle with the previous one P. -- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
