On Sun, September 13, 2009 14:13, ?lvaro Alves wrote: > I asked the question because in the PROJWFC documentation is written as > follows: The tetrahedron method is presently not implemented.
Dear Alvaro, I think you can specify the kind of smearing you want to use with the parameter ngauss, independently from what you've used for the scf calculation. Incidentally, I hope you have not uses the tetrahedra method for structure optimization: it is explicitly deprecated in the input manual. best regards -- Lorenzo Paulatto SISSA & DEMOCRITOS (Trieste) phone: +39 040 3787 511 skype: paulatz www: http://people.sissa.it/~paulatto/ ---------------------------------------------------------------- SISSA Webmail https://webmail.sissa.it/ Powered by SquirrelMail http://www.squirrelmail.org/
