Dear Lyudmila, Thanks for your kind response. To flip the spin of an atom, we edit in case.inst or else perform instgen_lapw. In the case.inst file, I do not found any forces. And also, the forces are observed in case.scf (after save_lapw) which is an scf files not input. But,you mentioned that it may be possible to take the input file containing forces (scf), and replace forces. Anyhow, I replaced the forces from this scf files as suggested and tried to arrange them. But could not make use of xcrysden to view the structure with arrows. By the way, after save_lapw, the saved file use to be very large containing the details of calculations. In that regard, will the replacement of forces only can solve the problem. Kindly help me to sort out this problem. Thank you M. P. Ghimire
On Mon, Jul 9, 2012 at 4:51 PM, Lyudmila Dobysheva <lyuka17 at mail.ru> wrote: > 07.07.2012 06:26, Madhav Ghimire wrote: > >> I am trying to view the picture of spins of >> the selected atoms under various AFM configuration like neel, stripe and >> zigzag. >> > > Dear M. P. Ghimire, > > Recently I looked at a result of arrows program which allows to visualize > forces acting at atoms with nice arrows. Maybe it is possible to take the > input file containing forces (scf), and replace forces - arrange them in > such a way that they correspond to your desired magnetic structure. Then > program arrows prepares input for x-crysden and xcrysden draws: > xcrysden --xsf case_forces.xsf > > Best regards > Lyudmila Dobysheva > ------------------------------**------------------------------**------ > Phys.-Techn. Institute of Ural Br. of Russian Ac. of Sci. > 426001 Izhevsk, ul.Kirova 132 > RUSSIA > ------------------------------**------------------------------**------ > Tel.:7(3412) 442118 (home), 218988(office), 250614(Fax) > E-mail: lyu at otf.pti.udm.ru > lyuka17 at mail.ru (office) lyuka17 at gmail.com (home) > Skype: lyuka17 (home), lyuka18 (office) > http://fti.udm.ru/content/**view/25/103/lang,english/<http://fti.udm.ru/content/view/25/103/lang,english/> > ------------------------------**------------------------------**------ > > > > ______________________________**_________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.**at <Wien at zeus.theochem.tuwien.ac.at> > http://zeus.theochem.tuwien.**ac.at/mailman/listinfo/wien<http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien> > -- M. P. Ghimire -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120710/8bd61299/attachment.htm>
