Publications of Matthias Scheffler

Ruggerone, P., A. Kley and M. Scheffler: Microscopic aspects of homoepitaxial growth. Progress in Surface Science 54 (3-4), 331–340 (1997).

Stampfl, C. and M. Scheffler: Mechanism of efficient carbon monoxide oxidation at Ru(0001). Journal of Vacuum Science and Technology A 15 (1), 1635–1641 (1997).

Stampfl, C. and M. Scheffler: Study of CO oxidation over Ru(0001) at high gas pressures. Surface Science 377-379, 808–812 (1997).

Stampfl, C. and M. Scheffler: Anomalous behavior of Ru for catalytic oxidation: A theoretical study of the catalytic reaction CO + 1/2 O₂ → CO₂. Physical Review Letters 78 (8), 1500–1503 (1997).

Tomanek, D., S. Wilke and M. Scheffler: Hydrogen-induced polymorphism of the Pd(110) surface. Physical Review Letters 79 (7), 1329–1332 (1997).

Yu, B.D. and M. Scheffler: Ab initio study of step formation and self-diffusion on Ag(100). Physical Review B 55 (20), 13916–13924 (1997).

Yu, B.D. and M. Scheffler: Physical origin of exchange diffusion on fcc(100) metal surfaces. Physical Review B 56, R15569–R15572 (1997).

Cho, J.-H. and M. Scheffler: Ab initio pseudopotential study of Fe, Co, and Ni employing the spin-polarized LAPW approach. Physical Review B 53 (16), 10685–10689 (1996).

Groß, A. and M. Scheffler: Influence of molecular vibrations on dissociative adsorption. Chemical Physics Letters 256 (4-5), 417–423 (1996).

Groß, A. and M. Scheffler: Scattering of hydrogen molecules from a reactive surface: strong off-specular and rotationally inelastic diffraction. Chemical Physics Letters 263 (3-4), 567–573 (1996).

Groß, A. and M. Scheffler: Gross and Scheffler Reply. Physical Review Letters 77 (2), 405–405 (1996).

Groß, A., S. Wilke and M. Scheffler: Six-dimensional quantum dynamics of adsorption and desorption of H₂ at Pd(100): no need for a molecular precursor adsorption state. Surface Science 357-358, 614–618 (1996).

Hennig, D., M.V. Ganduglia-Pirovano and M. Scheffler: Adlayer core-level shifts of admetal monolayers on transition metal substrates and their relation to the surface chemical reactivity. Physical Review B 53 (15), 10344–10347 (1996).

Kohler, B., P. Ruggerone and M. Scheffler: Anomalies in He atom scattering spectra of the H-covered Mo(110) and W(110) surfaces. Surface Science 368 (1-3), 213–221 (1996).

Kohler, B., P. Ruggerone, M. Scheffler and E. Tosatti: Enhanced electron-phonon coupling at the Mo and W(110) surfaces induced by adsorbed hydrogen. Zeitschrift für Physikalische Chemie 197, 193–202 (1996).

Kohler, B., S. Wilke, M. Scheffler, R. Kouba and C. Ambrosch-Draxl: Force calculation and atomic-structure optimization for the full-potential linearized augmented plane-wave code WIEN. Computer Physics Communications 94 (1), 31–48 (1996).

Moll, N., A. Kley, E. Pehlke and M. Scheffler: GaAs equilibrium crystal shape from first-principles. Physical Review B 54 (12), 8844–8855 (1996).

Petersen, M., S. Wilke, P. Ruggerone, B. Kohler and M. Scheffler: Scattering of rare-gas atoms at a metal surface: Evidence of anticorrugation of the helium-atom potential-energy surface and the surface electron density. Physical Review Letters 76 (6), 995–998 (1996).

Stampfl, C. and M. Scheffler: Theoretical study of O adlayers on Ru(0001). Physical Review B 54 (4), 2868–2872 (1996).

Stampfl, C., S. Schwegmann, H. Over, M. Scheffler and G. Ertl: Structure and stability of a high-coverage (1 x 1) oxygen phase on Ru(0001). Physical Review Letters 77 (16), 3371–3374 (1996).