Loïc Joubert-Doriol

Publications

Article dans une revue (8)

Quantum computer formulation of the FKP-operator eigenvalue problem for probabilistic learning on manifolds Christian Soize,Loïc Joubert-Doriol,Artur Izmaylov Computer Methods in Applied Mechanics and Engineering, 2025, 443, pp.118080. ⟨10.1016/j.cma.2025.118080⟩ Article dans une revue hal-05078073v1
Ultrafast proton transfer in a photoionized glycine by a mixed quantum–classical and quantum dynamics Kossi Kety,Jesús González-Vázquez,Piero Decleva,Jorge Delgado,Alicia Palacioset al. The Journal of Chemical Physics, 2025, 163 (16), pp.164122. ⟨10.1063/5.0288179⟩ Article dans une revue hal-05365978v1
Optimizing Conical Intersections without Explicit Use of Non-Adiabatic Couplings Juan Sanz García,Rosa Maskri,Alexander Mitrushchenkov,Loïc Joubert-Doriol Journal of Chemical Theory and Computation, 2024, 20 (13), pp.5643-5654. ⟨10.1021/acs.jctc.4c00326⟩ Article dans une revue hal-05028182v1
Quantum Kinetic Rates within the Nonequilibrium Steady State Loïc Joubert-Doriol,Kenneth Jung,Artur Izmaylov,Paul Brumer Journal of Chemical Theory and Computation, 2023, 19 (4), pp.1130-1143. ⟨10.1021/acs.jctc.2c00987⟩ Article dans une revue hal-04250730v1
The moving crude adiabatic alternative to the adiabatic representation in excited state dynamics Rosa Maskri,Loïc Joubert-Doriol Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, 2022, 380 (2223), ⟨10.1098/rsta.2020.0379⟩ Article dans une revue hal-03690112v1
Variational Approach for Linearly Dependent Moving Bases in Quantum Dynamics: Application to Gaussian Functions Loïc Joubert-Doriol Journal of Chemical Theory and Computation, 2022, 18 (10), pp.5799-5809. ⟨10.1021/acs.jctc.2c00461⟩ Article dans une revue hal-03825376v1
Controlling energy conservation in quantum dynamics with independently moving basis functions: Application to multi-configuration Ehrenfest Mina Asaad,Loïc Joubert-Doriol,Artur F. Izmaylov The Journal of Chemical Physics, 2022, 156 (20), pp.204121. ⟨10.1063/5.0087797⟩ Article dans une revue hal-03690111v1
A generalized vibronic-coupling Hamiltonian for molecules without symmetry: Application to the photoisomerization of benzopyran Benjamin Gonon,Benjamin Lasorne,Gabriel Karras,Loïc Joubert-Doriol,David Lauvergnatet al. The Journal of Chemical Physics, 2019, 150 (12), pp.124109. ⟨10.1063/1.5085059⟩ Article dans une revue hal-02108321v1