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Lista de obras de Nery Villegas-Escobar

A DFT analysis of the adsorption of nitrogen oxides on Fe-doped graphene, and the electric field induced desorption

A DFT study of hydrogen and methane activation by B(C6F5)3/P(t-Bu)3 and Al(C6F5)3/P(t-Bu)3 frustrated Lewis pairs

artículo científico publicado en 2017

Adsorption/desorption process of formaldehyde onto iron doped graphene: a theoretical exploration from density functional theory calculations

artículo científico publicado en 2016

Catalytic Mechanism of H2 Activation by a Carbenoid Aluminum Complex

scholarly article by Nery Villegas-Escobar et al published 17 November 2015 in Journal of Physical Chemistry C

Cover Feature: Double Gold Activation of 1-Ethynyl-2-(Phenylethynyl)Benzene Toward 5-exo -dig and 6-endo -dig Cyclization Reactions (Chem. Eur. J. 54/2017)

Decomposition of the electronic activity in competing [5,6] and [6,6] cycloaddition reactions between C60 and cyclopentadiene

artículo científico publicado en 2019

Double Gold Activation of 1-Ethynyl-2-(Phenylethynyl)Benzene Toward 5-exo-dig and 6-endo-dig Cyclization Reactions

artículo científico publicado en 2017

Fe-doped graphene nanosheet as an adsorption platform of harmful gas molecules (CO, CO2, SO2 and H2S), and the co-adsorption in O2 environments

Formation of Formic Acid Derivatives through Activation and Hydroboration of CO2 by Low-Valent Group 14 (Si, Ge, Sn, Pb) Catalysts

artículo científico publicado en 2020

Radicals derived from acetaldehyde and vinyl alcohol.

artículo científico publicado en 2017

Reaction Electronic Flux Perspective on the Mechanism of the Zimmerman Di-π-methane Rearrangement

scientific article published on 14 March 2018

Substituent effects on the photophysical properties of amino-aurone-derivatives

Symmetry-adapted reaction electronic flux in cycloaddition reactions

Toward a Neutral Single-Component Amidinate Iodide Aluminum Catalyst for the CO<sub>2</sub> Fixation into Cyclic Carbonates

artículo científico publicado en 2020

Why Low Valent Lead(II) Hydride Complex Would be a Better Catalyst for CO2 Activation than Its 14 Group Analogues?