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Dalton Transactions (Cambridge, England : 2003)|April 26, 2021
Magnetostructural relationships in [Ni(dmit)2]- radical anionsJhon Zapata-Rivera, Carmen J Calzado
Molecules (Basel, Switzerland)|March 22, 2019
Light-Induced Control of the Spin Distribution on Cu⁻Dithiolene Complexes: A Correlated Ab Initio StudyJhon Zapata-Rivera, Carmen J Calzado
Journal of Computational Chemistry|April 13, 2012
The role of macrocyclic ligands in the peroxo/superoxo nature of Ni-O2 biomimetic complexesJhon Zapata-Rivera, Rosa Caballol, Carmen J Calzado
Physical Chemistry Chemical Physics : PCCP|October 14, 2011
Comparing the peroxo/superoxo nature of the interaction between molecular O2 and β-diketiminato-copper and nickel complexesJhon Zapata-Rivera, Rosa Caballol, Carmen J Calzado
Physical Chemistry Chemical Physics : PCCP|December 16, 2014
Electronic structure aspects of the complete O2 transfer reaction between Ni(II) and Mn(II) complexes with cyclam ligandsJhon Zapata-Rivera, Rosa Caballol, Carmen J Calzado
Journal of Computational Chemistry|March 10, 2011
Electronic structure and relative stability of 1:1 Cu-O2 adducts from difference-dedicated configuration interaction calculationsJhon Zapata-Rivera, Rosa Caballol, Carmen J Calzado
Dalton Transactions (Cambridge, England : 2003)|September 5, 2019
Theoretical study of the photoconduction and photomagnetism of the BPY[Ni(dmit)2]2 molecular crystalJhon Zapata-Rivera, Rocío Sánchez-de-Armas, Carmen J Calzado
Chemistry (Weinheim an Der Bergstrasse, Germany)|September 3, 2014
On the reaction mechanism of the complete intermolecular O2 transfer between mononuclear nickel and manganese complexes with macrocyclic ligandsJhon Zapata-Rivera, Rosa Caballol, Carmen J Calzado, et al.
Inorganic Chemistry|October 23, 2024
Mechanism of Dinitrogen Photoactivation by P2PPhFe Complexes: Thermodynamic and Kinetic Computational StudiesCamilo Prada, Eugenia Dzib, Francisco Núñez-Zarur, et al.
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