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The Journal of Chemical Physics
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June 2, 2014
Non-adiabatic and intersystem crossing dynamics in SO2. II. The role of triplet states in the bound state dynamics studied by surface-hopping simulations
Sebastian Mai, Philipp Marquetand, Leticia González
The Journal of Physical Chemistry Letters
|
March 10, 2025
Efficient Excitonic Configuration Interaction for Large-Scale Multichromophoric Systems Using the Resolution-of-Identity Approximation
Tomislav Piteša, Sebastian Mai, Leticia González
The Journal of Physical Chemistry. A
|
November 2, 2023
Excited-State Dynamics Simulations of a Light-Driven Molecular Motor in Solution
Jin Wen, Sebastian Mai, Leticia González
Entropy (Basel, Switzerland)
|
December 8, 2020
Particle Swarm Contour Search Algorithm
Dominik Weikert, Sebastian Mai, Sanaz Mostaghim
Journal of Chemical Theory and Computation
|
May 1, 2019
Curious Case of 2-Selenouracil: Efficient Population of Triplet States and Yet Photostable
Sebastian Mai, Anna-Patricia Wolf, Leticia González
Journal of Chemical Theory and Computation
|
December 8, 2025
An Excitation Strategy for the Initial Condition Generation for Surface Hopping Trajectories Using Electron-Only Dynamics Including Explicit Laser Pulses
Lorenz Grünewald, Laurens van Dam, Sebastian Mai
Topics in Current Chemistry
|
October 3, 2014
Excitation of nucleobases from a computational perspective II: dynamics
Sebastian Mai, Martin Richter, Philipp Marquetand, et al.
Frontiers in Chemistry
|
November 3, 2018
Novel Molecular-Dynamics-Based Protocols for Phase Space Sampling in Complex Systems
Sebastian Mai, Hugo Gattuso, Antonio Monari, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
October 13, 2021
Jahn-Teller Effects in a Vanadate-Stabilized Manganese-Oxo Cubane Water Oxidation Catalyst
Sebastian Mai, Marcus Holzer, Anastasia Andreeva, et al.
Journal of Chemical Theory and Computation
|
June 17, 2024
Excitonic Configuration Interaction: Going Beyond the Frenkel Exciton Model
Tomislav Piteša, Severin Polonius, Leticia González, et al.
Page
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Search research articles
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Showing results (11-20 of 78) with videos related to
Sort By:
Page
of 8
The Journal of Chemical Physics
|
June 2, 2014
Non-adiabatic and intersystem crossing dynamics in SO2. II. The role of triplet states in the bound state dynamics studied by surface-hopping simulations
Sebastian Mai, Philipp Marquetand, Leticia González
The Journal of Physical Chemistry Letters
|
March 10, 2025
Efficient Excitonic Configuration Interaction for Large-Scale Multichromophoric Systems Using the Resolution-of-Identity Approximation
Tomislav Piteša, Sebastian Mai, Leticia González
The Journal of Physical Chemistry. A
|
November 2, 2023
Excited-State Dynamics Simulations of a Light-Driven Molecular Motor in Solution
Jin Wen, Sebastian Mai, Leticia González
Entropy (Basel, Switzerland)
|
December 8, 2020
Particle Swarm Contour Search Algorithm
Dominik Weikert, Sebastian Mai, Sanaz Mostaghim
Journal of Chemical Theory and Computation
|
May 1, 2019
Curious Case of 2-Selenouracil: Efficient Population of Triplet States and Yet Photostable
Sebastian Mai, Anna-Patricia Wolf, Leticia González
Journal of Chemical Theory and Computation
|
December 8, 2025
An Excitation Strategy for the Initial Condition Generation for Surface Hopping Trajectories Using Electron-Only Dynamics Including Explicit Laser Pulses
Lorenz Grünewald, Laurens van Dam, Sebastian Mai
Topics in Current Chemistry
|
October 3, 2014
Excitation of nucleobases from a computational perspective II: dynamics
Sebastian Mai, Martin Richter, Philipp Marquetand, et al.
Frontiers in Chemistry
|
November 3, 2018
Novel Molecular-Dynamics-Based Protocols for Phase Space Sampling in Complex Systems
Sebastian Mai, Hugo Gattuso, Antonio Monari, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
October 13, 2021
Jahn-Teller Effects in a Vanadate-Stabilized Manganese-Oxo Cubane Water Oxidation Catalyst
Sebastian Mai, Marcus Holzer, Anastasia Andreeva, et al.
Journal of Chemical Theory and Computation
|
June 17, 2024
Excitonic Configuration Interaction: Going Beyond the Frenkel Exciton Model
Tomislav Piteša, Severin Polonius, Leticia González, et al.
Page
of 8