Publications
2011:
1. Development of a semiempirical potential for simulations of thiol-gold interfaces. Application to thiol-protected gold nanoparticles. J. A. Olmos-Asar, A. Rapallo and M. M. Mariscal, Phys. Chem. Chem. Phys. 13 (2011) 6500-6506
2. Properties of Rotating Nanoalloys formed by cluster Collision: A Computer Simulation Study, S. A. Paz, E. P. M. Leiva, J. Jellinek and M. M. Mariscal, J. Chem. Phys 134 (2011) 094701.
2010:
3. Planar gold nanoclusters showing pentagonal atomic arrays revealed by aberration-corrected scanning transmission electron microscopy, A. Mayoral, D. A. Blom, M. M. Mariscal, C. Gutierrez-Wing, J. Aspiazu, M. J-Yacamán, Chem. Commun., (2010), 2010, 46, 8758-8760. - Seleccionado por Virtual Journal of Nanoscale Science & Technology (2010) Vol. 22 Issue 22
4. The Co-Au interface in bimetallic nanoparticles: A high resolution STEM study. A. Mayoral, S. Mejía-Rosales, M. M. Mariscal, E. Pérez-Tijerina and M. José-Yacamán, Nanoscale 2 (2010) 2647-2651.
5. A synthesis route of gold nanoparticles without using a reducing agent, C. Vargas-Hernandez, M. M. Mariscal and M. J. Yacaman, App. Phys. Lett. 96 (2010) 213115
6. On the atomic structure of thiol protected gold nanoparticles. A combined experimental and theoretical study. M. M. Mariscal, J. A. Olmos-Asar, C. Gutierrez-Wing, A. Mayoral and M. J. Yacaman, Phys. Chem. Chem. Phys. (2010), 12, 11785-11790
7. Computer simulation of the reversible electrochemical catalyst promoter doser. M. I. Rojas, M. M. Mariscal, E. P. M. Leiva Electrochimica Acta, 55 (2010) 8673–8679.
8. Theoretical Studies of Preparation of Core-Shell Nanoparticles by Electrochemical Metal Deposition. O. A. Oviedo, M. M. Mariscal, E. P. M. Leiva. Electrochimica Acta 55 (2010) 8244–8251
9. On the Occurrence of Stable and Metastable States in Metallic Core-shell Nanoparticles O. A. Oviedo, M. M. Mariscal E. P. M. Leiva. Phys. Chem. Chem. Phys. 12 (2010) 4580 – 4589
2009:
10. The behavior of single-molecule junctions predicted by atomistic simulations J. A. Olmos Asar, E. P. M. Leiva and M. M. Mariscal, Electrochem. Comm. 11 (2009) 987. (Pub.: Elsevier)
11. Stochastic model for spontaneous formation of molecular wires J. A. Olmos Asar, M. M. Mariscal and E. P. M. Leiva, Electrochim. Acta. 54 (2009) 2977.
12. On the structural and mechanical properties of Fe-filled carbon
nanotubes – A computer simulation approach G. Soldano and M. M. Mariscal, Nanotechnology 20 (2009) 165705 (Pub.: IOP)
2008
13. Diffusion mechanisms taking place at the early stages of cobalt deposition on Au(111) O. A. Oviedo, E. P. M. Leiva and M. M. Mariscal, J. Phys.: Condens. Matter 20 (2008) 265010 (Pub.: Institute of Physics)
14. Thermodynamic considerations and computer simulations on the spontaneous formation of core-shell nanoparticles under electrochemical conditions. O. A. Oviedo, E. P. M. Leiva and M. M. Mariscal, Phys. Chem. Chem. Phys., 10 (2008) 3561, seleccionado como HOT-ARTICLE (Pub.: Royal Society of Chemistry)
15. Computer simulation of the effective double layer occurring on a catalyst surface under electrochemical promotion conditions, E. P. M. Leiva, C. Vazquez, M. I. Rojas and M. M. Mariscal, Journal of Applied Electrochemistry 38 (2008) 1065, (Pub.: Springer)
16. Atomistic Computer Simulations on the Generation of Bimetallic Nanoparticles, M. Mariscal, N. A. Oldani, S.A. Dassie and E.P.M. Leiva, Faraday Discussions, 136 (2008) 06. (Pub.: Royal Society of Chemistry)
2007
17. Computer simulation of electrochemical nanostructuring induced by supersaturation conditions - M. Mariscal, S.A. Dassie and E.P.M. Leiva, Journal of Electroanalytical Chemistry, 607 (2007) 10 (Pub.: Elsevier)
18. Computer simulation of the effective double layer occurring on a catalyst surface under electrochemical promotion conditions. E. P. M. Leiva, C. Vazquez, M. I. Rojas and M. M. Mariscal, OREPOC Proceedings book 10-13 (2007).
19. The structure of electrodeposits – computer simulation study. - M. Mariscal, E.P.M. Leiva, K. Pötting and W. Schmickler, Applied Physics A. 87 (2007) 385. (Pub.: Springer)
2006
20. A new simulation model for electrochemical metal deposition- W. Schmickler, K. Pötting and M. Mariscal, Chemical Physics, 320 (2006) 149. (5° lugar en 25HotArticles) (Pub.: Elsevier)
2005
21. Collision as a way of forming bimetallic nanoclusters of various structures and chemical compositions- M. Mariscal, S.A. Dassie and E.P.M. Leiva, Journal of Chemical Physics, 123 (2005) 184505. (Pub:. American Institute of Physics)
22. On the generation of metal clusters with the electrochemical scanning tunneling microscope - M. Del Pópolo, E. P Leiva, M. Mariscal, and W. Schmickler, Surface Science 597 (2005) 133. (Pub.: Elsevier)
23. Effects of tip structure on the generation of metal clusters by an STM tip: a way to control the orientation on nanocristallites. - M. Mariscal, C. Narambuena, M. Del Pópolo, E. P Leiva, Nanotechnology 16 (2005) 974. (Pub.: Institute of Physics)
24. On the surface properties of lead structures on Au (111), an atom dynamic approach – M. Mariscal and W. Schmickler, Journal of Electroanalytical Chemistry 582 (2005) 64. (Pub.: Elsevier)
2003
25. Proton binding at clay surface in water - M. Avena, M. Mariscal and C. De Pauli, Appied Clay Science 24 (2003) 3. (Pub.: Elsevier)
26. The basis for the formation of stable metal clusters on an electrode surface - M. Del Pópolo, E.P Leiva, M. Mariscal, and W. Schmickler, Nanotechnology 14 (2003) 1009. (Pub.: Institute of Physics)
27. A combinate experimental and theorical study of the generation of palladium clusters on Au(111) with a scanning tunnelling microscope - M. Del Pópolo, E.P. Leiva, H. Kleine, J. Meier, U. Stimming, M. Mariscal, and W. Schmickler, Electrochimica Acta 48 (2003) 1287. (Pub.: Elsevier)
2002
28. Generation and stability of metal clusters generated with the EC-STM - M. Mariscal, M. Del Pópolo, E. P Leiva, and W. Schmickler, High Temperature Society of Japan, (2002) pp. 260-265 - ISBN: 0387-1096.
29. Generation of palladium cluster on Au(111)- experiments and simulations - M. Del Pópolo, E. P Leiva, H. Kleine, J. Meier, U. Stimming, M. Mariscal, and W. Schmickler, Appied Physics Letters, 81, (2002), 2635. (Pub:. American Institute of Physics)
