Publications of Maria Veronica Ganduglia-Pirovano

Baron, M.; Abbott, H.; Bondarchuk, O.; Stacchiola, D.; Uhl, A.; Shaikhutdinov, S.; Freund, H.-J.; Popa, C.; Ganduglia-Pirovano, M. V.; Sauer, J.: Resolving the atomic structure of vanadia monolayer catalysts: monomers, trimers, and oligomers on ceria. Angewandte Chemie 121 (43), pp. 8150 - 8153 (2009)

Domínguez-Ariza, D.; Sousa, C.; Harrison, N. M.; Ganduglia-Pirovano, V.; Illas, F.: Effect of surface model on the theoretical description of the chemisorption of atomic hydrogen on Cu(0 0 1). Surface Science 522 (1-3), pp. 185 - 197 (2003)

Ganduglia-Pirovano, M. V.; Reuter, K.; Scheffler, M.: Stability of subsurface oxygen at Rh(111). Physical Review B 65 (24), 245426 (2002)

Reuter, K.; Ganduglia-Pirovano, M. V.; Stampfl, C.; Scheffler, M.: Metastable precursors during the oxidation of the Ru(0001) surface. Physical Review B 65 (16), 165403 (2002)

Reuter, K.; Stampfl, C.; Ganduglia-Pirovano, M. V.; Scheffler, M.: Atomistic description of oxide formation on metal surfaces: the example of ruthenium. Chemical Physics Letters 352 (5-6), pp. 311 - 317 (2002)

Stampfl, C.; Ganduglia-Pirovano, M. V.; Reuter, K.; Scheffler, M.: Catalysis and corrosion: the theoretical surface-science context. Surface Science 500 (1-3), pp. 368 - 394 (2002)

Todorova, M.; Li, W.; Ganduglia-Pirovano, M. V.; Stampfl, C.; Reuter, K.; Scheffler, M.: Role of sub-surface oxygen in oxide formation at transition metal surfaces. Physical Review Letters 89 (9), 096103 (2002)

Rodriguez, C. O.; Ganduglia-Pirovano, M. V.; Peltzer y Blancá, E. L.; Petersen, M.: First-principles study of hyperfine fields in a Cd impurity in the Fe/Ag(100) interface. Physical Review B 64 (14), 144419 (2001)

Ganduglia-Pirovano, M. V.; Scheffler, M.; Baraldi, A.; Lizzit, S.; Comelli, G.; Paolucci, G.; Rosei, R.: Oxygen induced Rh 3d_5/2 surface core-level shifts on Rh(111). Physical Review B 63 (20), pp. 205415-1 - 205415-11 (2001)

Lizzit, S.; Baraldi, A.; Groso, A.; Reuter, K.; Ganduglia-Pirovano, M. V.; Stampfl, C.; Scheffler, M.; Stichler, M.; Keller, C.; Wurth, W. et al.; Menzel, D.: Surface core level shifts of clean and oxygen covered Ru(0001). Physical Review B 63 (20), 205419 (2001)

Rodriguez, C. O.; Ganduglia-Pirovano, M. V.; Peltzer y Blancá, E. L.; Petersen, M.; Novák, P.: Orbital and dipolar contributions to the hyperfine fields in bulk bcc Fe, hcp Co and at the Fe/Ag(100) interface: The inclusion of orbital polarization. Physical Review B 63 (18), 184413 (2001)

Ganduglia-Pirovano, M. V.; Scheffler, M.: Structural and electronic properties of chemisorbed oxygen on Rh(111). Physical Review B 59 (23), pp. 15533 - 15543 (1999)

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)

Ganduglia-Pirovano, M. V.; Natoli, V.; Cohen, M. H.; Kudrnovsky, J.; Turek, I.: Potential, core-level, and d band shifts at transition-metal surfaces. Physical Review B 54 (12), pp. 8892 - 8898 (1996)

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

Cohen, M. H.; Ganduglia-Pirovano, M. V.; Kudrnovský, J.: Reactivity kernels, the normal modes of chemical reactivity, and the hardness and softness spectra. Journal of Chemical Physics 103, pp. 3543 - 3551 (1995)