publication

1994

Journal Article

Bormet, Jörg, Bernd Wenzien and Matthias Scheffler: A self-consistent surface Green-function (SSGF) method for the calculation of isolated adsorbate atoms on a semi-infinite crystal.

MPG.PuRe

DOI

Journal Article

Dabrowski, J., Eckard Pehlke and Matthias Scheffler: Relation between the atomic structure and the surface-stress anisotropy: Calculations for the clean Si(001) surface.

MPG.PuRe

DOI

Journal Article

Dabrowski, J., Eckard Pehlke and Matthias Scheffler: Calculation of the surface stress anisotropy for the buckled Si(001)(1x2) and p(2x2) surfaces.

MPG.PuRe

DOI

Journal Article

Groß, Axel, Bjørk Hammer, Matthias Scheffler and Wilhelm Brenig: High-dimensional quantum dynamics of adsorption and desorption of H₂ at Cu(111).

MPG.PuRe

DOI

Journal Article

Hammer, Bjørk, Matthias Scheffler, Karsten W. Jacobsen and Jens K. Norskov: Multidimensional potential energy surface for H₂ dissociation over Cu(111).

MPG.PuRe

DOI

Journal Article

Heinemann, Martina and Matthias Scheffler: Thick sodium overlayers on GaAs(110).

MPG.PuRe

DOI

Journal Article

Hennig, D., Michael Methfessel and Matthias Scheffler: Ab initio calculation of surface core-level shifts for transition metal surfaces.

MPG.PuRe

DOI

Journal Article

Kohler, Bernd, Martin Fuchs, Karsten Freihube and Matthias Scheffler: Comment on "Local exchange-correlation functional: Numerical test for atoms and ions".

MPG.PuRe

DOI

Journal Article

Kraft, Thomas, P.M. Marcus and Matthias Scheffler: Atomic and magnetic structure of fcc Fe/Cu(100).

MPG.PuRe

DOI

Journal Article

Neugebauer, Jörg and Matthias Scheffler: Alkali-metal adsorbates on aluminum (111): The interplay and competition of adsorbate-substrate and adsorbate-adsorbate interactions.

MPG.PuRe

DOI

Journal Article

Pankratov, Oleg and Matthias Scheffler: Surface polarons and bipolarons at GaAs(110) with adsorbed alkali metals.

MPG.PuRe

DOI

Journal Article

Stampfl, Catherine, Jörg Neugebauer and Matthias Scheffler: Alkali-metal adsorption on Al(111) and Al(100).

MPG.PuRe

DOI

Journal Article

Stampfl, Catherine, Jörg Neugebauer and Matthias Scheffler: Theoretical evidence for unusual bonding geometry and phase transitions of Na on Al(001).

MPG.PuRe

DOI

Journal Article

Stampfl, Catherine and Matthias Scheffler: Theoretical identification of a (2 x 2) composite double layer ordered surface alloy of Na on Al(111).

MPG.PuRe

DOI

Journal Article

Stampfl, Catherine, Matthias Scheffler, Herbert Over, J. Burchhardt, M. Nielsen, D.D. Adams and W. Moritz: LEED structural analysis of Al(111)-K(√3 x √3)R30°: Identification of stable and metastable adsorption sites.

MPG.PuRe

DOI

Journal Article

Stumpf, Roland and Matthias Scheffler: Mechanisms of self-diffusion on flat and stepped Al surfaces.

MPG.PuRe

DOI

Journal Article

Stumpf, Roland and Matthias Scheffler: Simultaneous calculation of the equilibrium atomic structure and its electronic ground state using density-functional theory.

MPG.PuRe

DOI

Journal Article

Stumpf, Roland and Matthias Scheffler: Theory of self-diffusion at and growth of Al(111).

MPG.PuRe

Journal Article

Wilke, Steffen, D. Hennig, R. Löber, Michael Methfessel and Matthias Scheffler: Ab-initio study of hydrogen adsorption on Pd(100).

MPG.PuRe

DOI

Journal Article

Yamada, K., T. Kraft, T. Aisaka, Akira Ishii and Matthias Scheffler: Spin- and angle-resolved UPS spectrum calculation for ferromagnetic Nickel.

MPG.PuRe