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Journal of Chemical Theory and Computation
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November 7, 2024
Enhancing <i>Eyringpy</i>: Accurate Rate Constants with Canonical Variational Transition State Theory and the Hindered Rotor Model
Eugenia Dzib, Alan Quintal, Gabriel Merino
Journal of Computational Chemistry
|
November 13, 2025
Microcanonical Rate Constants With Rice-Ramsperger-Kassel-Marcus in Eyringpy
Aura Gómez-Heredia, Eugenia Dzib, Gabriel Merino
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 5, 2022
Acid Dissociation in (HX)<sub>n</sub> (H<sub>2</sub> O)<sub>n</sub> Clusters (X=F, Cl, Br, I; n=2, 3)
Alba Vargas-Caamal, Eugenia Dzib, Filiberto Ortiz-Chi, et al.
Molecules (Basel, Switzerland)
|
January 16, 2020
Revisiting the Rearrangement of Dewar Thiophenes
Sara Gómez, Edison Osorio, Eugenia Dzib, et al.
Inorganic Chemistry
|
October 23, 2024
Mechanism of Dinitrogen Photoactivation by P<sub>2</sub>P<sup>Ph</sup>Fe Complexes: Thermodynamic and Kinetic Computational Studies
Camilo Prada, Eugenia Dzib, Francisco Núñez-Zarur, et al.
Chemical Science
|
May 27, 2021
Planar tetracoordinate fluorine atoms
Gabriela Castillo-Toraya, Mesías Orozco-Ic, Eugenia Dzib, et al.
Chemical Science
|
June 7, 2021
<i>trans</i>-Hydroboration-oxidation products in Δ<sup>5</sup>-steroids <i>via</i> a hydroboration-<i>retro</i>-hydroboration mechanism
J Ciciolil Hilario-Martínez, Fernando Murillo, Jair García-Méndez, et al.
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Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
November 7, 2024
Enhancing <i>Eyringpy</i>: Accurate Rate Constants with Canonical Variational Transition State Theory and the Hindered Rotor Model
Eugenia Dzib, Alan Quintal, Gabriel Merino
Journal of Computational Chemistry
|
November 13, 2025
Microcanonical Rate Constants With Rice-Ramsperger-Kassel-Marcus in Eyringpy
Aura Gómez-Heredia, Eugenia Dzib, Gabriel Merino
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 5, 2022
Acid Dissociation in (HX)<sub>n</sub> (H<sub>2</sub> O)<sub>n</sub> Clusters (X=F, Cl, Br, I; n=2, 3)
Alba Vargas-Caamal, Eugenia Dzib, Filiberto Ortiz-Chi, et al.
Molecules (Basel, Switzerland)
|
January 16, 2020
Revisiting the Rearrangement of Dewar Thiophenes
Sara Gómez, Edison Osorio, Eugenia Dzib, et al.
Inorganic Chemistry
|
October 23, 2024
Mechanism of Dinitrogen Photoactivation by P<sub>2</sub>P<sup>Ph</sup>Fe Complexes: Thermodynamic and Kinetic Computational Studies
Camilo Prada, Eugenia Dzib, Francisco Núñez-Zarur, et al.
Chemical Science
|
May 27, 2021
Planar tetracoordinate fluorine atoms
Gabriela Castillo-Toraya, Mesías Orozco-Ic, Eugenia Dzib, et al.
Chemical Science
|
June 7, 2021
<i>trans</i>-Hydroboration-oxidation products in Δ<sup>5</sup>-steroids <i>via</i> a hydroboration-<i>retro</i>-hydroboration mechanism
J Ciciolil Hilario-Martínez, Fernando Murillo, Jair García-Méndez, et al.
Page
of 1