cd $WIENROOT cd SRC_supercell check the file compile.msg
eventually just recompile: make cp supercell .. Am 18.01.2012 08:09, schrieb arqum hashmi: > Thanks Sir Mohaddeseh, > i am very thankful to you for giving me suggestion. > but it is not working also with changing name from TiC.struct to > super.struct. it also give the error this > Command not found. > 0.000u 0.000s 0:00.00 0.0% 0+0k 0+0io 0pf+0w > error: command /home/hashumi/WIEN2k/supercell supercell.def failed > please tell me why this problem occured and how i can solve it. > Thanks and regards > Arqum Hashmi > > > ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- > *From:* mohaddeseh abbasnejad <m.abbasnejad at gmail.com> > *To:* A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at> > *Sent:* Tuesday, January 17, 2012 10:03 PM > *Subject:* Re: [Wien] required help in constructing supercell TiC.struct to > super.struct > > Dear Arqum hashmi, > > This is not a serious problem. > You only need to change the name of "TiC" to the name of the directory you > are working in. > In your case, it should be changed to super.struct (instead of TiC.struct). > > Yours, > Mohaddeseh > -- > --------------------------------------------------------- > > Mohaddeseh Abbasnejad, > Room No. 323, Department of Physics, > University of Tehran, North Karegar Ave., > Tehran, P.O. Box: 14395-547- IRAN > Tel. No.: +98 21 6111 8634 & Fax No.: +98 21 8800 4781 > Cellphone: +98 917 731 7514 > E-Mail: m.abbasnejad at gmail.com <mailto:m.abbasnejad at gmail.com> > Website: http://physics.ut.ac.ir > > --------------------------------------------------------- > > > 2012/1/18 arqum hashmi <arqumhashmi at yahoo.com <mailto:arqumhashmi at > yahoo.com>> > > Dear Users > i have problem in constructing supercell. > as given in userguide i Create a new directory, copy the original > TiC.struct file into it and when i run supercell it gives this error. > hashumi at spin4:~/WIEN2k/TiC/super> x supercell > cut: super.struct: No such file or directory > /home/hashumi/WIEN2k/supercell: Command not found. > 0.000u 0.000s 0:00.00 0.0% 0+0k 0+0io 0pf+0w > error: command /home/hashumi/WIEN2k/supercell supercell.def failed > > > Please can anyone tell me about his problem and how can i solve it. i > will be very thankful to you. > > Thanks and regards > Arqum hashmi > > _______________________________________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.at <mailto:Wien at > zeus.theochem.tuwien.ac.at> > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > > > > > > > _______________________________________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.at <mailto:Wien at zeus.theochem.tuwien.ac.at> > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > > > > > _______________________________________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien -- P.Blaha -------------------------------------------------------------------------- Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna Phone: +43-1-58801-165300 FAX: +43-1-58801-165982 Email: blaha at theochem.tuwien.ac.at WWW: http://info.tuwien.ac.at/theochem/ --------------------------------------------------------------------------
