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Journal of Chemical Theory and Computation
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November 29, 2021
Surface Hopping Dynamics with the Frenkel Exciton Model in a Semiempirical Framework
Eduarda Sangiogo Gil, Giovanni Granucci, Maurizio Persico
The Journal of Chemical Physics
|
August 27, 2024
Exact factorization of the photon-electron-nuclear wavefunction: Formulation and coupled-trajectory dynamics
Eduarda Sangiogo Gil, David Lauvergnat, Federica Agostini
The Journal of Chemical Physics
|
November 1, 2022
Frenkel exciton photodynamics of self-assembled monolayers of azobiphenyls
Eduarda Sangiogo Gil, Maurizio Persico, Giovanni Granucci
The Journal of Physical Chemistry. B
|
December 21, 2024
Photoisomerization Dynamics of Azo-Escitalopram Using Surface Hopping and a Semiempirical Method
Hans Georg Gallmetzer, Eduarda Sangiogo Gil, Leticia González
Journal of Chemical Theory and Computation
|
September 16, 2024
Excitonic Approach for Nonadiabatic Dynamics: Extending Beyond the Frenkel Exciton Model
Eduarda Sangiogo Gil, Andrea Giustini, Davide Accomasso, et al.
Chemical Science
|
December 20, 2024
SHARC meets TEQUILA: mixed quantum-classical dynamics on a quantum computer using a hybrid quantum-classical algorithm
Eduarda Sangiogo Gil, Markus Oppel, Jakob S Kottmann, et al.
Journal of Chemical Theory and Computation
|
August 22, 2025
Velocity Rescaling in Surface Hopping Based on Atomic Contributions to Electronic Transitions
Eduarda Sangiogo-Gil, Lea M Ibele, Richard Bleyer, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 17, 2024
Simulations of photoinduced processes with the exact factorization: state of the art and perspectives
Lea Maria Ibele, Eduarda Sangiogo Gil, Evaristo Villaseco Arribas, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 16, 2019
CASPT2, CASSCF and non-adiabatic molecular dynamics (NAMD) studies on the low-lying electronic states of 1H-1,2,3-triazole photolysis
Eduarda Sangiogo Gil, Bruno Bercini de Araújo, Paulo F B Gonçalves
The Journal of Physical Chemistry Letters
|
December 15, 2023
On the Nature of Geometric and Topological Phases in the Presence of Conical Intersections
Lea M Ibele, Eduarda Sangiogo Gil, Basile F E Curchod, et al.
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of 2
Search research articles
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Showing results (1-10 of 16) with videos related to
Sort By:
Page
of 2
Journal of Chemical Theory and Computation
|
November 29, 2021
Surface Hopping Dynamics with the Frenkel Exciton Model in a Semiempirical Framework
Eduarda Sangiogo Gil, Giovanni Granucci, Maurizio Persico
The Journal of Chemical Physics
|
August 27, 2024
Exact factorization of the photon-electron-nuclear wavefunction: Formulation and coupled-trajectory dynamics
Eduarda Sangiogo Gil, David Lauvergnat, Federica Agostini
The Journal of Chemical Physics
|
November 1, 2022
Frenkel exciton photodynamics of self-assembled monolayers of azobiphenyls
Eduarda Sangiogo Gil, Maurizio Persico, Giovanni Granucci
The Journal of Physical Chemistry. B
|
December 21, 2024
Photoisomerization Dynamics of Azo-Escitalopram Using Surface Hopping and a Semiempirical Method
Hans Georg Gallmetzer, Eduarda Sangiogo Gil, Leticia González
Journal of Chemical Theory and Computation
|
September 16, 2024
Excitonic Approach for Nonadiabatic Dynamics: Extending Beyond the Frenkel Exciton Model
Eduarda Sangiogo Gil, Andrea Giustini, Davide Accomasso, et al.
Chemical Science
|
December 20, 2024
SHARC meets TEQUILA: mixed quantum-classical dynamics on a quantum computer using a hybrid quantum-classical algorithm
Eduarda Sangiogo Gil, Markus Oppel, Jakob S Kottmann, et al.
Journal of Chemical Theory and Computation
|
August 22, 2025
Velocity Rescaling in Surface Hopping Based on Atomic Contributions to Electronic Transitions
Eduarda Sangiogo-Gil, Lea M Ibele, Richard Bleyer, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 17, 2024
Simulations of photoinduced processes with the exact factorization: state of the art and perspectives
Lea Maria Ibele, Eduarda Sangiogo Gil, Evaristo Villaseco Arribas, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 16, 2019
CASPT2, CASSCF and non-adiabatic molecular dynamics (NAMD) studies on the low-lying electronic states of 1H-1,2,3-triazole photolysis
Eduarda Sangiogo Gil, Bruno Bercini de Araújo, Paulo F B Gonçalves
The Journal of Physical Chemistry Letters
|
December 15, 2023
On the Nature of Geometric and Topological Phases in the Presence of Conical Intersections
Lea M Ibele, Eduarda Sangiogo Gil, Basile F E Curchod, et al.
Page
of 2