Jean Louis Rivail

Centre National de la Recherche Scientifique — France

Physics and Astronomy · Physical Sciences

11h-index869citations12works0.02yr avg
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Research Topics

Spectroscopy and Quantum Chemical Studies(6), Advanced Chemical Physics Studies(5), Molecular spectroscopy and chirality(5), Photochemistry and Electron Transfer Studies(2), Various Chemistry Research Topics(2)

Publications12 total

Solvent effect on the radical addition reaction to double bond: Experimental and quantum chemical investigations
Chemical Physics Letters·2005· 23 cited
Hydroxide Ion in Liquid Water: Structure, Energetics, and Proton Transfer Using a Mixed Discrete-Continuum ab Initio Model
The Journal of Physical Chemistry·1995· 103 cited
Proton Transfer in the Mono- and the Dihydrated Complexes of HF and HCl: An MP2/6-31+G ab Initio Study in the Self-Consistent Reaction Field Model of Solvation
The Journal of Physical Chemistry·1994· 59 cited
Peptide models. 3. Conformational potential energy hypersurface of formyl-L-valinamide
Journal of the American Chemical Society·1993· 77 cited
Solvent effects on molecular geometries and isomerization processes: a study of push-pull ethylenes in solution
Journal of the American Chemical Society·1993· 84 cited
Modeling amino acid side chains. 1. Determination of net atomic charges from ab initio self-consistent-field molecular electrostatic properties
The Journal of Physical Chemistry·1992· 84 cited
Computation of accurate electronic molecular polarizabilities
The Journal of Physical Chemistry·1992· 62 cited
Molecular dynamics simulation of the TIPS model of 1,2-dichloroethane in the liquid phase
Molecular Physics·1992· 13 cited
Peptide models. 1. Topology of selected peptide conformational potential energy surfaces (glycine and alanine derivatives)
Journal of the American Chemical Society·1991· 246 cited
Protonation of nitrogen-containing bases in solution: continuum vs. discrete-continuum models for aqueous solutions
The Journal of Physical Chemistry·1985· 62 cited
Calcul thorique des polarisabilits lectroniques molculaires. Comparaison des diffrentes mthodes@@@Calculation of molecular electronic polarizabilities. Comparison of different methods
Theoretical Chemistry Accounts·1974
Calcul th�orique des polarisabilit�s �lectroniques mol�culaires. Comparaison des diff�rentes m�thodes
Theoretical Chemistry Accounts·1974· 56 cited

Frequent Co-authors

Daniel Rinaldi(5), András Perczel(2), Wládia Viviani(2), Imre G. Csizmadia(2), Manuel F. Ruiz‐López(2), Christophe Chipot(2), Enrique Sánchez Marcos(2), János G. Ángyán(1), M. Kajtár(1), John Frank Marcoccia(1), Iñaki Tuñón(1), Bernard Maigret(1), Harold A. Scheraga(1), Rafael R. Pappalardo(1), Bernard Terryn(1), Christophe Voisin(1), Alain Cartier(1), Leonid Gorb(1), Jacques Lalevée(1), Xavier Allonas(1)