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Journal of Chemical Theory and Computation
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September 5, 2024
Quantum Dynamics from Classical Trajectories
Rafael S Mattos, Saikat Mukherjee, Mario Barbatti
Physical Chemistry Chemical Physics : PCCP
|
July 26, 2024
Gravitationally-induced wave function collapse time for molecules
Anderson A Tomaz, Rafael S Mattos, Mario Barbatti
The Journal of Chemical Physics
|
December 4, 2025
Ehrenfest dynamics with spontaneous localization
Anderson A Tomaz, Rafael S Mattos, Saikat Mukherjee, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 28, 2026
Ultrafast dynamics and excited-state trapping in [3.3]paracyclophane
Muhammad Tahir Hafeez, Rafael S Mattos, Lea M Ibele, et al.
The Journal of Chemical Physics
|
April 16, 2024
Prediction Challenge: Simulating Rydberg photoexcited cyclobutanone with surface hopping dynamics based on different electronic structure methods
Saikat Mukherjee, Rafael S Mattos, Josene M Toldo, et al.
Journal of Chemical Theory and Computation
|
January 11, 2024
Recommendations for Velocity Adjustment in Surface Hopping
Josene M Toldo, Rafael S Mattos, Max Pinheiro, et al.
Journal of the American Chemical Society
|
December 19, 2022
On the Cooperative Origin of Solvent-Enhanced Symmetry-Breaking Charge Transfer in a Covalently Bound Tetracene Dimer Leading to Singlet Fission
Rafael S Mattos, Irene Burghardt, Adelia J A Aquino, et al.
Journal of Chemical Theory and Computation
|
December 16, 2024
Assessing Nonadiabatic Dynamics Methods in Long Timescales
Saikat Mukherjee, Yorick Lassmann, Rafael S Mattos, et al.
Digital Discovery
|
January 31, 2025
ULaMDyn: enhancing excited-state dynamics analysis through streamlined unsupervised learning
Max Pinheiro, Matheus de Oliveira Bispo, Rafael S Mattos, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 16, 2026
The Newton-X platform for mixed quantum-classical dynamics
Mario Barbatti, Rafael S Mattos, Baptiste Demoulin, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 10) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
September 5, 2024
Quantum Dynamics from Classical Trajectories
Rafael S Mattos, Saikat Mukherjee, Mario Barbatti
Physical Chemistry Chemical Physics : PCCP
|
July 26, 2024
Gravitationally-induced wave function collapse time for molecules
Anderson A Tomaz, Rafael S Mattos, Mario Barbatti
The Journal of Chemical Physics
|
December 4, 2025
Ehrenfest dynamics with spontaneous localization
Anderson A Tomaz, Rafael S Mattos, Saikat Mukherjee, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 28, 2026
Ultrafast dynamics and excited-state trapping in [3.3]paracyclophane
Muhammad Tahir Hafeez, Rafael S Mattos, Lea M Ibele, et al.
The Journal of Chemical Physics
|
April 16, 2024
Prediction Challenge: Simulating Rydberg photoexcited cyclobutanone with surface hopping dynamics based on different electronic structure methods
Saikat Mukherjee, Rafael S Mattos, Josene M Toldo, et al.
Journal of Chemical Theory and Computation
|
January 11, 2024
Recommendations for Velocity Adjustment in Surface Hopping
Josene M Toldo, Rafael S Mattos, Max Pinheiro, et al.
Journal of the American Chemical Society
|
December 19, 2022
On the Cooperative Origin of Solvent-Enhanced Symmetry-Breaking Charge Transfer in a Covalently Bound Tetracene Dimer Leading to Singlet Fission
Rafael S Mattos, Irene Burghardt, Adelia J A Aquino, et al.
Journal of Chemical Theory and Computation
|
December 16, 2024
Assessing Nonadiabatic Dynamics Methods in Long Timescales
Saikat Mukherjee, Yorick Lassmann, Rafael S Mattos, et al.
Digital Discovery
|
January 31, 2025
ULaMDyn: enhancing excited-state dynamics analysis through streamlined unsupervised learning
Max Pinheiro, Matheus de Oliveira Bispo, Rafael S Mattos, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 16, 2026
The Newton-X platform for mixed quantum-classical dynamics
Mario Barbatti, Rafael S Mattos, Baptiste Demoulin, et al.
Page
of 1