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Jorge Ignacio Martínez-Araya

Andrés Bello National University

30

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Analysis in silico of chemical reactivity employing the local hyper-softness in some classic aromatic compounds, boron aromatic clusters and all-metal aromatic clusters.

2022 Journal of Computational Chemistry
- Jorge Ignacio Martínez-Araya
- Rafael Islas
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Editorial: Endemic Plants: Experimental and Theoretical Insights Into Properties of Bioactive Metabolites With Therapeutic Potential.

2021 Frontiers in chemistry
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1,3-Dipolar Cycloadditions by a Unified Perspective Based on Conceptual and Thermodynamics Models of Chemical Reactivity.

2021 Journal of Physical Chemistry A
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The density polarization reveals directions of electron displacements due to the substituent effect: Analysis performed on a metal-organic Mo-Oxo catalyst.

2021 Journal of Computational Chemistry
- Jorge Ignacio Martínez-Araya
- Christophe Morell
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KID Procedure Applied on the [(PY5Me2)MoO]+ Complex

2020
- Daniel Glossman-Mitnik
- Jorge Ignacio Martínez-Araya
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Assessment of the KID Procedure on a Mo–oxo Complex, an Open–Shell System

2020
- Jorge Ignacio Martínez-Araya
- Daniel Glossman-Mitnik
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A statistical thermodynamics view of electron density polarisation: Application to chemical selectivity

2020 Physical Chemistry Chemical Physics
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Effect of the exchange–correlation functional on the synchronicity/nonsynchronicity in bond formation in Diels–Alder reactions: a reaction force constant analysis

2019 Physical Chemistry Chemical Physics
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Scrutinizing Substituent Effect on Mo-Based Electrocatalysts for Molecular Hydrogen Release through an Axial-Equatorial Decomposition: A DFT Study

2019 Physical Chemistry Chemical Physics
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Assessment of a set of twelve density functionals to estimate the global reactivity of myricetin through the Koopmans’ theorem

2019 Chemical Physics Letters
- Claudia Sandoval-Yáñez
- Jorge Ignacio Martínez-Araya
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