What about reading the UG ? The new version WIEN2k_10 has a initso, which does it for you automatically.
Am 23.10.2010 08:36, schrieb Mahmoud Farout: > in the file *.inso > 1 1 1 magnetization direction > NX number of atoms ...... > NX1 ......... > > NX , NX1 must be edited? > If yes , help me, what are their format? > Numbers or what? > I am trying -so calculation first time using FeN ,FCC crystal > > On Fri Oct 22nd, 2010 10:00 PM IST Mahmoud Farout wrote: > >> thank you >> but I don't understand you >> what did you mean by typo?? >> >> --- On Fri, 10/22/10, Stefaan Cottenier<Stefaan.Cottenier at UGent.be> >> wrote: >> >> From: Stefaan Cottenier<Stefaan.Cottenier at UGent.be> >> Subject: Re: [Wien] WIEN(Spin orbit calculation) >> To: wien at zeus.theochem.tuwien.ac.at >> Date: Friday, October 22, 2010, 9:05 PM >> >> >>> forrtl :severe(64) : input conversion error , unit 5, file >>> ./root/........./test_so.inso >> >> 'input conversion error' : probably a typo in case.inso ? >> >> Stefaan >> >> >> >> _______________________________________________ >> Wien mailing list >> 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 -- Peter Blaha Inst.Materials Chemistry TU Vienna Getreidemarkt 9 A-1060 Vienna Austria +43-1-5880115671