E-LIB Suche - Ergebnisse für: Toro-Labbé, Alejandro

1

Basis Electronic Activity of Molecular Systems. A Theory of..:

Benítez, Francisca J. ; Gutiérrez-Oliva, Soledad ; Herrera, Bárbara.
The Journal of Physical Chemistry A. 128 (2024) 10 - p. 1902-1912 , 2024

Link: https://doi.org/10.1021/..

2

Foreword for the Festschrift on the occasion of the 65th bi..:

De Proft, Frank ; Ayers, Paul W. ; Liu, Shubin..
Theoretical Chemistry Accounts. 143 (2024) 2 - p. , 2024

Link: https://doi.org/10.1007/..

3

Elucidating the electronic synergetic effects in heteroatom..:

Escobar, Gonzalo ; Venegas, Ricardo ; Ponce, Ingrid...
Electrochimica Acta. 466 (2023) - p. 143060 , 2023

Link: https://doi.org/10.1016/..

4

High-Level Coupled-Cluster Study on Substituent Effects in ..:

Villegas-Escobar, Nery ; Hoobler, Preston R. ; Toro-Labbé, Alejandro.
The Journal of Physical Chemistry A. 127 (2023) 4 - p. 956-965 , 2023

Link: https://doi.org/10.1021/..

5

Using reactivity predictors for enhancing the electrocataly..:

Scarpetta-Pizo, Laura ; Venegas, Ricardo ; Muñoz-Becerra, Karina...
Electrochimica Acta. 468 (2023) - p. 143160 , 2023

Link: https://doi.org/10.1016/..

6

The transition state region in nonsynchronous concerted rea..:

Gómez, Sara ; Rojas-Valencia, Natalia ; Toro-Labbé, Alejandro.
The Journal of Chemical Physics. 158 (2023) 8 - p. , 2023

Link: https://doi.org/10.1063/..

7

Digging on the mechanism of some Diels–Alder reactions: the..:

Hernández-Mancera, Jennifer Paola ; Vivas-Reyes, Ricardo ; Gutiérrez-Oliva, Soledad..
Theoretical Chemistry Accounts. 142 (2023) 8 - p. , 2023

Link: https://doi.org/10.1007/..

8

Complexation of AAPH (2,2′-azobis(2-methylpropionamidine) d..:

Forero-Girón, Angie C. ; Fuentealba, Denis ; Mariño-Ocampo, Nory...
Journal of Molecular Liquids. 389 (2023) - p. 122840 , 2023

Link: https://doi.org/10.1016/..

9

How Does Electronic Activity Drive Chemical Reactions? Insi..:

Forero-Girón, Angie Carolay ; Toro-Labbé, Alejandro
The Journal of Physical Chemistry A. 126 (2022) 26 - p. 4156-4163 , 2022

Link: https://doi.org/10.1021/..

10

Chemiluminescence emission in Fenton reaction driven by 1,2..:

Romero, Romina ; Márquez, Katherine ; Benítez, Francisca J....
Journal of Photochemistry and Photobiology A: Chemistry. 426 (2022) - p. 113744 , 2022

Link: https://doi.org/10.1016/..

11

New guanidine-borane adducts: An experimental and theoretic..:

Rojas, René S. ; Muñoz-Becerra, Karina ; Toro-Labbé, Alejandro...
Inorganica Chimica Acta. 518 (2021) - p. 120217 , 2021

Link: https://doi.org/10.1016/..

12

First-principles study of hybrid nanostructures formed by d..:

Cortés-Arriagada, Diego ; Miranda-Rojas, Sebastián ; Cid-Mora, Francisca.
Journal of Molecular Liquids. 333 (2021) - p. 115948 , 2021

Link: https://doi.org/10.1016/..

13

Mapping experimental and theoretical reactivity descriptors..:

Matute, Ricardo A. ; Toro-Labbé, Alejandro ; Oyarzún, María P....
Electrochimica Acta. 391 (2021) - p. 138905 , 2021

Link: https://doi.org/10.1016/..

14

Substituent Effects on Aluminyl Anions and Derived Systems:..:

Hoobler, Preston R. ; Villegas-Escobar, Nery ; Turney, Justin M...
The Journal of Physical Chemistry A. 125 (2021) 48 - p. 10379-10391 , 2021

Link: https://doi.org/10.1021/..

15

Tribute to Paul Geerlings:

Ayers, Paul W. ; Chattaraj, Pratim Kumar ; De Proft, Frank.
The Journal of Physical Chemistry A. 124 (2020) 25 - p. 5061-5062 , 2020

Link: https://doi.org/10.1021/..