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Alan Quintal
Alan Quintal
PdD student, Cinvestav
Dirección de correo verificada de cinvestav.mx
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Automating the IRC‐Analysis within Eyringpy
A Quintal, E Dzib, F Ortíz‐Chi, P Jaque, A Restrepo, G Merino
International Journal of Quantum Chemistry 121 (16), e26684, 2021
122021
Unveiling the electronic and structural consequences of removing two electrons from B 12 H 12 2−
G Hernández-Juárez, A Vásquez-Espinal, F Murillo, A Quintal, F Ortíz-Chi, ...
Dalton Transactions 52 (46), 17398-17406, 2023
32023
SurfinPES: Performing automated analysis of activation strain, energy decomposition, and reaction force
A Quintal, E Dzib, F Murillo, F Ortíz‐Chi, I Fernández, G Merino
International Journal of Quantum Chemistry 124 (1), e27194, 2024
22024
Revisiting the formation mechanism of diarylamines via Smiles rearrangement
F Murillo, A Quintal, E Dzib, X Zarate, MA Fernández‐Herrera, G Merino
Journal of Physical Organic Chemistry 35 (12), e4427, 2022
22022
C3H8O2 Isomers: Insights into Potential Interstellar Species
L Noriega, LA González-Ortiz, F Ortíz-Chi, A Quintal, SI Ramírez, ...
The Journal of Physical Chemistry A 128 (46), 9964-9971, 2024
2024
Enhancing Eyringpy: Accurate Rate Constants with Canonical Variational Transition State Theory and the Hindered Rotor Model
E Dzib, A Quintal, G Merino
Journal of Chemical Theory and Computation 20 (22), 9999-10009, 2024
2024
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Artículos 1–6