[Pw_forum] q-points unit
giannozz at democritos.it
Sun May 22 17:39:09 CEST 2011
On May 22, 2011, at 17:21 , Seyed Mojtaba Rezaei Sani wrote:
> Pardon me but I can't find any clue about this matter in any of
> output files.
the three vectors generating the reciprocal lattice are reprinted on
QE does not use "conventional" cells, only "primitive" cells.
Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
More information about the users