Dear WIEN2k experts, I'm trying to view forces on atoms using *arrows *utility in WIEN2k package (version 9.2). I followed the instructions in the corresponding version of WIEN2k user's guide. I copied my /case.struct /and /case.scf /to /case_initial.struct/ and /case_initial.scf/ respectively. Then I viewed the structure using XCrysDen program (version 1.4) in Windows through X-server and saved the structure as /case_initial.xsf/ file. The command 'x arrow' finished successfully, and it generated *case_initial.forces* file, but in the UG it says that the file should be case_forces.xsf. I tried both commands:
xcrysden --xsf case forces.xsf or xcrysden --xsf case_initial.forces As a result I cannot see neither structure nor forces (empty screen in xcrysden). I believe that the problem is connected with the names of the file with forces, but I cannot identify correct name. Could anybody help me to make it working? Should I attach any files? Thanks, Maxim -- Best regards, Maxim Rakitin SUSU, Chelyabinsk, Russia email: rms85 at physics.susu.ac.ru web: http://www.susu.ac.ru -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120516/67d2e91f/attachment.htm>