[Wien] The Rashba-effect calculations

2008-08-25 Thread Oleg Artamonov
Dear Wien2k users, I am going to use the Wirn2k for calculation of the Rashba effect (spin splitting of the valence band on the surface of the crystal) in nonmagnetic crystals. I know examples only of the application the FLEUR-project to this kind of calculations. Is there somebody who has an e

[Wien] QTL Projection f-7/2

2008-08-25 Thread D.A. Tompsett
Dear All, I am using the latest WIEN2k_08.2. I am working on a 4f metallic system and am interested in using QTL to investigate the occupation of the J=7/2 f-states. I would like to get the charge projection of the J=7/2 states to be able to make some comment about the valence of my sys