Dear Wien2k users and Prof. Blaha I am trying to calculate magneto-optical properties of some 3d transition metal. For this purpose we need to do spin orbit coupling calculation first. For normal optics calculation with spin-polarization option we need to do addjoint_lapw to join case.outputjoint(up/dn) and form case.joint file. Then we proceed with "x kram" My confusion is do we need to do addjoint_lapw also for spin polarized spin-orbit coupling case since the spins are not independent any more.
any clarification will be very helpful. Thanks and regards -- Soumyajyoti Haldar, PhD Student Department of Physics and Astronomy, Materials Theory ?ngstr?m Laboratory, Office ?13235 | Uppsala University Box 516, SE-75120, Uppsala, SWEDEN Phone: (+46) 18 471 5860 Mobile: (+46) 070 0399 394 http://www.physics.uu.se/en/page/soumyajyoti-haldar -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120628/e40dfe9d/attachment.htm>
