Institut de Chimie Physique

Nos tutelles

	David LAUVERGNAT Chercheur Groupe TheoSim
Contact	Tél. : +33 (0)1 69 15 44 44 Fax : +33 (0)1 69 15 44 47 Courriel : david.lauvergnat@universite-paris-saclay.fr
Localisation	Bât 349
Informations complémentaires	Page Personnelle 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)