Publications of Matthias Scheffler

Alippi, P.; Marcus, P. M.; Scheffler, M.: Strained tetragonal states and bain paths in metals. Physical Review Letters 78 (20), pp. 3892 - 3895 (1997)

Arnold, M.; Hupfauer, G.; Bayer, P.; Hammer, L.; Heinz, K.; Kohler, B.; Scheffler, M.: Hydrogen on W(110): an adsorption structure revisited. Surface Science 382 (1-3), pp. 288 - 299 (1997)

Bockstedte, M.; Kley, A.; Neugebauer, J.; Scheffler, M.: Density-functional theory calculations for poly-atomic systems: electronic structure, static and elastic properties and ab initio molecular dynamics. Computer Physics Communications 107 (1-3), pp. 187 - 222 (1997)

Bockstedte, M.; Scheffler, M.: Theory of Self-Diffusion in GaAs. Zeitschrift für Physikalische Chemie 200 (1-2), pp. 195 - 207 (1997)

Cho, J.-H.; Scheffler, M.: Surface relaxation and ferromagnetism of Rh(001). Physical Review Letters 78 (7), pp. 1299 - 1302 (1997)

Ganduglia-Pirovano, M. V.; Kudrnovský, J.; Scheffler, M.: Adlayer core-level shifts of random metal overlayers on transition-metal substrates. Physical Review Letters 78 (9), pp. 1807 - 1810 (1997)

Groß, A.; Bockstedte, M.; Scheffler, M.: Ab initio molecular dynamics study of the desorption of D₂ from Si(100). Physical Review Letters 79 (4), pp. 701 - 704 (1997)

Groß, A.; Scheffler, M.: Role of zero-point effects in catalytic reactions involving hydrogen. Journal of Vacuum Science and Technology A 15 (3), pp. 1624 - 1629 (1997)

Groß, A.; Scheffler, M.: Steering and ro-vibrational effects on dissociative adsorption and associative desorption of H₂Pd(100). Progress in Surface Science 53 (2-4), pp. 187 - 196 (1997)

Kley, A.; Ruggerone, P.; Scheffler, M.: Novel diffusion mechanism on the GaAs (001) surface: the role of adatom-dimer interaction. Physical Review Letters 79 (26), pp. 5278 - 5281 (1997)

Kohler, B.; Ruggerone, P.; Scheffler, M.: Ab initio study of the anomalies in the He-atom-scattering spectra of H/Mo(110) and H/W(110). Physical Review B 56 (20), pp. 13503 - 13518 (1997)

Narasimhan, S.; Scheffler, M.: A Model for the Thermal Expansion of Ag(111) and other Metal Surfaces. Zeitschrift für Physikalische Chemie 202 (1-2), pp. 253 - 262 (1997)

Pehlke, E.; Moll, N.; Kley, A.; Scheffler, M.: Shape and stability of quantum dots. Applied Physics A 65 (6), pp. 525 - 534 (1997)

Ratsch, C.; Seitsonen, A. P.; Scheffler, M.: Strain dependence of surface diffusion: Ag on Ag(111) and Pt(111). Physical Review B 55 (11), pp. 6750 - 6753 (1997)

Ruggerone, P.; Kley, A.; Scheffler, M.: Bridging the length and time scales: from ab initio electronic structure calculations to macroscopic proportions. Psi-k Newsletter 21, pp. 75 - 87 (1997)

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

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

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

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

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