On Fri, Apr 19, 2013 at 9:37 AM, shiva mokhavat <shiva.mokhavat at gmail.com> wrote: > sorry, I am a new user of Quantum espresso...:-(
then you shouldn't start with a complex calculation in the first place. like with any other skill, you won't be able to learn it over night and you will need to acquire it in stages, making sure at each step that you understand where potential sources of errors are (usually by making errors and identifying and correcting them). there ain't no such thing as a free lunch. axel. > > > On Fri, Apr 19, 2013 at 12:00 PM, mohnish pandey <mohnish.iitk at gmail.com> > wrote: >> >> Dear Shiva, >> >> Please devote sometime in framing the question, try to avoid posting >> anything whatever comes to your mind without giving a second thought about >> it. By the description of your problem I am sure nobody will be able to help >> you. You have to post very specific questions, please don't be to naive. I >> hope you understand. >> >> >> On Fri, Apr 19, 2013 at 9:17 AM, shiva mokhavat <shiva.mokhavat at gmail.com> >> wrote: >>> >>> dear all >>> I am trying to calculate optical properties of HgTe, but the results are >>> not correct.can anyone help me in this? >>> >>> _______________________________________________ >>> Pw_forum mailing list >>> Pw_forum at pwscf.org >>> http://pwscf.org/mailman/listinfo/pw_forum >> >> >> >> >> -- >> Regards, >> MOHNISH, >> ----------------------------------------------------------------- >> Mohnish Pandey, >> PhD Student, >> Center for Atomic Scale Materials Design, >> Department of Physics, >> Technical University of Denmark >> ----------------------------------------------------------------- >> >> _______________________________________________ >> Pw_forum mailing list >> Pw_forum at pwscf.org >> http://pwscf.org/mailman/listinfo/pw_forum > > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum -- Dr. Axel Kohlmeyer akohlmey at gmail.com http://goo.gl/1wk0 International Centre for Theoretical Physics, Trieste. Italy.