On Mon, 2014-02-03 at 15:58 +0100, yelena wrote: > [...] > elph. 0.000000. 0.096225. 0.000000 > [...]
> What am I missing? the white spaces in file names P. > Best, > Jelena > > > On 31 Jan 2014 13:01, Lorenzo Paulatto wrote: > > On 01/31/2014 01:02 PM, yelena wrote: > >> Hi! > >> I'm trying to make lambda.x input, but I can't get proper number of > >> kpoints using kpoints.x. Is there any other way to calculate kpoints > >> for > >> lambda.x? > >> In electron phonon calculation I'm using 12 12 1 grid and get 43 q > >> points and when I do kpoints.x for 12 12 1 I get 19 points. I'm > >> having > >> hexagonal structure with 7 atoms. What can I do? > >> > > Dear Yelena, > > the electron phonon calculation may be using both the k and k+q > > points, eventually with different symmerty. They are not necessary > > the > > same produced by kpoints.x > > > > bests > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum -- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
