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David LAUVERGNAT

Chercheur
Groupe TheoSim
ContactTél. : +33 (0)1 69 15 44 44
Fax : +33 (0)1 69 15 44 47
Courriel : david.lauvergnat@universite-paris-saclay.fr
LocalisationBât 349
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Travaux et publications



Publications récentes
Relaxation dynamics through a conical intersection: Quantum and quantum–classical studies.
Pieroni, Carlotta; Marsili, Emanuele; Lauvergnat, David; Agostini, Federica
J. Chem. Phys. 154:034104 (2021)  
Spin-Orbit Interactions in Ultrafast Molecular Processes.
Talotta, Francesco; Morisset, Sabine; Rougeau, Nathalie; Lauvergnat, David; Agostini, Federica
Phys. Rev. Lett. 124:033001 (2020)  
Internal Conversion and Intersystem Crossing with the Exact Factorization.
Talotta, Francesco; Morisset, Sabine; Rougeau, Nathalie; Lauvergnat, David; Agostini, Federica
J. Chem. Theory Comput. 16:4833 (2020)  
Quantum and quantum-classical studies of the photoisomerization of a retinal chromophore model.
Marsili, Emanuele; Olivucci, Massimo; Lauvergnat, David; Agostini, Federica
J. Chem. Theory Comput. 16:6032−6048 (2020)  
First-principles description of intra-chain exciton migration in an oligo(para-phenylene vinylene) chain. I. Generalized Frenkel-Holstein Hamiltonian.
Binder, Robert; Bonfanti, Matteo ; Lauvergnat, David ; Burghardt, Irene
J. Chem. Phys. 152:204119 (2020)