%0 Journal Article %1 Szunyogh1994a %A Szunyogh, L %A Ujfalussy, B %A Weinberger, P %A Kollar, J %D 1994 %J Journal of Physics: Condensed Matter %K imported %N 18 %P 3301-3306 %T The self-consistent fully relativistic SKKR Green function method: applications to the (100), (110) and (111) surfaces of Au and Pt %U http://stacks.iop.org/0953-8984/6/3301 %V 6 %X The fully relativistic version of the screened Korringa-Kohn-Rostoker (SKKR) method is discussed and applied charge self-consistently to the (100), (110) and (111) surfaces of Au and Pt. In comparison to corresponding semi-relativistic calculations for Au it is found that spectral densities depend very crucially on the inclusion of relativistic effects. In terms of work functions, however, the difference between the semi-relativistic and the relativistic calculations is rather small.

@article{Szunyogh1994a, abstract = {The fully relativistic version of the screened Korringa-Kohn-Rostoker (SKKR) method is discussed and applied charge self-consistently to the (100), (110) and (111) surfaces of Au and Pt. In comparison to corresponding semi-relativistic calculations for Au it is found that spectral densities depend very crucially on the inclusion of relativistic effects. In terms of work functions, however, the difference between the semi-relativistic and the relativistic calculations is rather small.}, added-at = {2009-09-09T17:55:18.000+0200}, author = {Szunyogh, L and Ujfalussy, B and Weinberger, P and Kollar, J}, biburl = {https://www.bibsonomy.org/bibtex/2e9c7738a61bd942e09737cdda6b0730e/pbuczek}, file = {Szunyogh1994a.pdf:Szunyogh1994a.pdf:PDF;Szunyogh1994a.pdf:Szunyogh1994a.pdf:PDF}, interhash = {0015d7d88b57e880d92ccdac374df472}, intrahash = {e9c7738a61bd942e09737cdda6b0730e}, journal = {Journal of Physics: Condensed Matter}, keywords = {imported}, number = 18, owner = {pbuczek}, pages = {3301-3306}, timestamp = {2009-09-09T17:55:35.000+0200}, title = {The self-consistent fully relativistic SKKR Green function method: applications to the (100), (110) and (111) surfaces of Au and Pt}, url = {http://stacks.iop.org/0953-8984/6/3301}, volume = 6, year = 1994 }