Merhaba emine,
Thanks a lot for your response. I hope this will help.I am studying at university of Akron, Oh, USA. Gulcin On Oct 20, 2011, at 4:58 AM, Emine Kucukbenli <kucukben at sissa.it> wrote: > > Merhaba Gulcin, > Try running the example input files in the examples directory. > You will see that every run_example is nothing but a script that > generates the input files (text) and > invokes the necessary executable (such as pw.x). > you can take a look at run_example, it is not binary. > > If you suspect you are missing something in the format of input files, > just edit one of the input files generated by the run_example > to represent your system and calculation. > > to understand the keywords used take a look at their descriptions. > The following is the description of input for pw.x executable: > > http://www.quantum-espresso.org/input-syntax/INPUT_PW.html > > You seem to be at the beginning of things, > if available, local help would let you advance faster than the mailing list. > If you provide your affiliation, > your chances of finding someone in your area/institute is higher, > cheers > > emine kucukbenli, phd student, sissa, italy > > Quoting Gulcin Kucukdalyan <gkucukdalyan at gmail.com>: > >> Dear Mohnish, >> >> Thanks a lot for your response. I am trying to prepare an input file >> for graphene. I just prepared a text file and tried to run it and >> did not work. I really cannot find detailed explanation about how to >> prepare an input file. Can you please suggest me any if exist? >> >> Gulcin >> >> On Oct 19, 2011, at 10:53 PM, mohnish pandey <mohnish.iitk at gmail.com> >> wrote: >> >>> Dear Gulcin ! >>> >>> To run an an input file for example an input file of pw.x you >>> should invoke the command for pw.x. /espresso directory/bin/pw.x >>> <abc.scf.in> abc.scf.out. In this /espresso directory/ is the >>> address to espresso directory, "abc.scf.in" is the name of the QE >>> input file and "abc.scf.out" is the the QE output file. This is the >>> crudest way to run an input file. And next time please mention your >>> affiliation. Hope it helps. >>> >>> On Thu, Oct 20, 2011 at 2:22 AM, Gulcin Kucukdalyan >>> <gkucukdalyan at gmail.com> wrote: >>> HI All, >>> >>> Could you please tell me how can i run an input file. It is the >>> second time i am asking this question. Last time i was asked to >>> read tutorials. It is not specified there if i have to prepare a >>> text file or an executable file (run_example) like the ones in the >>> examples. If i have to prepare a text file how can i run it. >>> >>> Thanks, >>> >>> Gulcin >>> >>> _______________________________________________ >>> Pw_forum mailing list >>> Pw_forum at pwscf.org >>> http://www.democritos.it/mailman/listinfo/pw_forum >>> >>> >>> >>> >>> -- >>> Regards, >>> MOHNISH, >>> ----------------------------------------------------------------- >>> Mohnish Pandey >>> BTech-Mtech, IIT Kanpur >>> Senior Project Associate, >>> 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 > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum
