Thanks a lot Dr. Eyvaz. On Wed, Dec 22, 2010 at 6:06 PM, Eyvaz Isaev <eyvaz_isaev at yahoo.com> wrote:
> Hi, > > Just go to /Modules/parameters.f90, and change ntypx=10 to that you want > to. > Then make clean and make pw (or whatever you want to re-compile). > > Bests, > Eyvaz. > > ------------------------------------------------------------------- > Prof. Eyvaz Isaev, > Department of Physics, Chemistry, and Biology (IFM), Linkoping University, > Sweden > Theoretical Physics Department, Moscow State Institute of Steel & Alloys, > Russia, > isaev at ifm.liu.se, eyvaz_isaev at yahoo.com > > > ------------------------------ > *From:* mohnish pandey <mohnish.iitk at gmail.com> > *To:* PWSCF Forum <pw_forum at pwscf.org> > *Sent:* Wed, December 22, 2010 1:30:07 PM > *Subject:* [Pw_forum] calculation for system having number of different > species greater than 10 > > Dear QE users, > I want to do some calculations having number of > different species greater than 10. I want to know is it possible to increase > the dimension of QE for more than 10 different species. > > -- > Regards, > MOHNISH, > ----------------------------------------------------------------- > Mohnish Pandey > Y6927262,5th Year dual degree student, > Department of Chemical Engineering, > IIT KANPUR, UP, INDIA > ----------------------------------------------------------------- > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > > -- Regards, MOHNISH, ----------------------------------------------------------------- Mohnish Pandey Y6927262,5th Year dual degree student, Department of Chemical Engineering, IIT KANPUR, UP, INDIA ----------------------------------------------------------------- -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20101222/8b00df99/attachment.htm
