Browsing by Author "Toro Labbé, Alejandro"

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    • Comparative study of the electrocatalytic activity of cobalt phthalocyanine and cobalt naphthalocyanine for ... 
      Isaacs, M.; Aguirre, M. J.; Toro Labbé, Alejandro; Costamagna, J.; Páez, M.; Zagal Moya, José H. (Elsevier Ltd, 1998)
      Cobalt phthalocyanine (CoPc) and cobalt naphthalocyanine (CoNPc) exhibit different redox and electronic properties. Redox processes on CoPc are more reversible than on CoNPc. The pH dependence of those processes is also ...
    • Relations between potential energy, electronic chemical potential, and hardness profiles 
      Cárdenas Jirón, G.; Gutiérrez Oliva, Soledad; Melin, Junia; Toro Labbé, Alejandro (American Chemical Society, 1997)
      In recent papers we defined a theoretical frame aimed at characterizing the hardness and potential energy profiles along a reduced reaction coordinate (omega) varying from 0 to 1. In this paper we generalize that model to ...
    • Solvent effects on electrophilicity 
      Pérez, P.; Toro Labbé, Alejandro; Contreras Ramos, Renato (American Chemical Society, 2001)
      Continuum solvent effect on the electrophilicity index recently proposed by Parr and co-workers (Parr, R. G.; von Szentpaly, L.; Liu, S. J. Am. Chem. Soc. 1999, 121, 1922) is discussed in detail. Solvent effect is introduced ...