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  1. Efectos del Confinamiento y de entornos Polipeptídicos en la Reactividad intrínseca de Cationes de Metales de transición

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    Descrizione: In the first part of this thesis, the behavior of intrinsic reactivity parameters for a representative sample of first row transition metal cations is studied under spherical con- finement conditions by solving numerically the non-relativistic spin polarized Kohn-Sham equations for atoms. It was determined that, in contrast with neutral atoms,...
    Soggetto: Cationes, Transition metals compounds, Reactivity (Chemistry), Compuestos de metales de transición, Reactividad (Química), and Cations
    Creatore: Lozano Espinosa, Mayra
    Collaboratore: Martínez Vázquez, Ana María, Galván Espinoza, Marcelo Enrique, Cortés Guzmán, Fernando, Vargas Fosada, Rubicelia, Gázquez Mateos, José Luis, and Galano Jiménez, Annia
    Editore: Universidad Autónoma Metropolitana
    Posgrado: Doctorado en Ciencias Quimica
    Lingua: spa
    Año de publicación: 2017
    Diritti: Acceso Abierto
    Licenza: Atribucion-NoComercial 4.0 Internacional (CC BY-NC 4.0)
    Tipo de Recurso: Tesis de Maestría
    Identifier: https://doi.org/10.24275/uami.vx021f09b