Dr. Paul Fleurat-Lessard

Profil

Derzeitige StellungProfessor W-1 und Äquivalente
FachgebietTheoretische Chemie: Elektronenstruktur, Dynamik, Simulation,Anorganische Molekülchemie
KeywordsAb Initio Molecular Dynamics, Theoretical chemistry, Organic Chemistry, BioChemistry, Statistical theories

Aktuelle Kontaktadresse

LandFrankreich
OrtDijon
Universität/InstitutionUniversite de Bourgogne
Institut/AbteilungInstitute of Molecular Chemistry - UMR CNRS 6103

Gastgeber*innen während der Förderung

Prof. Dr. Jürgen TroeInstitut für Physikalische Chemie, Georg-August-Universität Göttingen, Göttingen
Dr. Reinhard SchinkeAbteilung Nichtlineare Dynamik, Max-Planck-Institut für Dynamik und Selbstorganisation, Göttingen
Beginn der ersten Förderung01.02.2002

Programm(e)

2001Humboldt-Forschungsstipendien-Programm

Publikationen (Auswahl)

2006Reinhard Schinke, Sergy Y. Grebenschikov, M. Ivanov, Paul Fleurat-Lessard: Dynamical Studies of the Ozone Isotope Effect A Status Report. In: Annual Review of Physical Chemistry, 2006, 625-661
2005Reinhard Schinke, Paul Fleurat-Lessard: The effect of zero-point energy differences on the isotope dependence of the formation of ozone A classical trajectory study.. In: J. Chem. Phys. , 2005, 094317
2004Reinhard Schinke, Paul Fleurat-Lessard: The transition-state region of the O(3P)+O2(3 Sigma g -) potential energy surface. In: J. Chem. Phys. , 2004, 5789
2003D. Babikov, B. K. Kendrick, R. B. Walker, R. T. Pack, P. Fleurat-Lessard, R. Schinke: Formation of ozone Metastable states and anomalous isotope effect. In: Journal of Chemical Physics, 2003, 2577
2003Vandana Kurkal, Paul Fleurat-Lessard, Reinhard Schinke: Global potential energy surfaces of the ground (2A1) and the first excited (2B2) electronic states. In: J. Chem. Phys. , 2003, 1489
2003R. Schinke, P. Fleurat-Lessard, S. Yu. Grebenschikov: Isotope Dependence of the Lifetime of Ozone Complexes formed in O + O2 collisions.. In: Phys. Chem. Chem. Phys. , 2003, 1966
2003P. Fleurat-Lessard, S. Yu. Grebenschikov, R. Schinke, C. Janssen, D. Krankowsky, K. Mauesberger: Isotope dependance of the O + O2 exchange reaction Experiment and theory.. In: J. Chem. Phys. , 2003, 4700
2003D. Babikov, B. K. Kendrick, R. B. Walker, R. T. Pack, P. Fleurat-Lessard, R. Schinke: Metastable states of ozone calculated on an accurate potential energy surface. In: Journal of Chemical Physics, 2003, 6298
2003Paul Fleurat-Lessard, Sergy Yu. Grebenshchikov, Rüdiger Siebert, Reinhard Schinke, Nadine Halberstadt : Theoretical investigation of the temperature dependence of the O + O2 exchange reaction . In: Journal of Chemical Physics, 2003, 610-621
2002R. Siebert, P. Fleurat-Lessard, R. Schinke, M. Bittererová, S. C. Farantos: The vibrational energies of ozone up to the dissociation threshold: Dynamics calculations on an accurate potential energy surface.. In: Journal of Chemical Physics, 2002, 9749-9767