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David LAUVERGNAT

Animateur du groupe
Chercheur
Groupe TheoSim
ContactTél. : +33 (0)1 69 15 44 44
Fax : +33 (0)1 69 15 44 47
Courriel : david.lauvergnat@u-psud.fr
LocalisationBât 349
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Travaux et publications



Publications récentes
A generalized vibronic-coupling Hamiltonian for molecules without symmetry: Application to the photoisomerization of benzopyran.
Gonon, Benjalin; Lasorne, Benjamin; Karras, Gabriel; Joubert-Doriol, loïc; Lauvergnat, David; Billard, Franck; Lavorel, Bruno;Faucher, Olivier; Olivier, Stéphane; Hertz, Edouard; Gatti, Fabien
J. Chem. Phys. 150:124109 (2019)  
H2, HD, and D2 in the small cage of structure II clathrate hydrate: Vibrational frequency shifts from fully coupled quantum six-dimensional calculations of the vibration-translation-rotation eigenstates.
Lauvergnat, David; Felker, Peter; Scribano, Yohann; Benoit, David, M.; Bačić, Zlatko
J. Chem. Phys. 150:154303 (2019)  
Femtosecond wave-packet revivals in ozone.
Latka, T. ; Shirvanyan,V. ; Ossiander,M. ; Razskazovskaya, O. ; Guggenmos,A. ; Jobst, M. ; Fieß, M. ; Holzner,S. ; Sommer, A. ; Schultze,M. ; Jakubeit, C. ; Riemensberger, J. ; Bernhardt, B. ; Helml, W. ; Gatti, F. ; Lasorne, B. ; Lauvergnat, D. ; Decleva, P. ; Halász, G. J. ; Vibók, Á. ; Kienberger, R.
Phys. Rev. A 99:063405 (2019)  
The effect of the condensed-phase environment on the vibrational frequency shift of a hydrogen molecule inside clathrate hydrates.
Powers, Anna; Scribano, Yohann; Lauvergnat, David; Benoit, David; Mebe, Elsy; Bačić, Zlatko
J. Chem. Phys. 148:144304 (2018)  
Ultrafast internal conversion in 4-aminobenzonitrile occurs sequentially along the seam.
Castro, Pedro J.; Perveaux, Aurelie; Lauvergnat, David; Reguero, Mar; Lasorne, Benjamin
Chem. Phys. 509:30−36 (2018)