Química Física
Fachbereich
Paul Sabatier University
Tolosa, FranciaPublikationen in Zusammenarbeit mit Forschern von Paul Sabatier University (14)
2002
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Molecular dynamics simulation of the I2(X)···Ar isomers population in a free-jet expansion: Thermodynamics versus kinetic control
Journal of Chemical Physics, Vol. 116, Núm. 5, pp. 1944-1953
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Size evolution of the vibrational predissociation process in Br2···Nen clusters: Simulation and kinetic study
Faraday Discussions, Vol. 118, Núm. 1, pp. 257-268
2001
2000
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Experimental and theoretical study of the photofragmentation process: Ar3++hν→Ar2++Ar
Journal of Chemical Physics, Vol. 113, Núm. 6, pp. 2175-2181
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Mixed quantum classical steps: A DVR hopping method
PhysChemComm, Vol. 3, pp. 29-35
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Time evolution of reactants, intermediates, and products in the vibrational predissociation of Br2···Ne: A theoretical study
Journal of Chemical Physics, Vol. 113, Núm. 22, pp. 10130-10142
1999
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Competition between electronic and vibrational predissociation in Ar-I 2(B) : A molecular dynamics with quantum transitions study
Chemical Physics, Vol. 240, Núm. 1-2, pp. 229-239
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Hybrid quantum/classical simulation and kinetic study of the vibrational predissociation of Cl2⋯Nen (n=2, 3)
Journal of Chemical Physics, Vol. 111, Núm. 10, pp. 4577-4588
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Intramolecular vibrational redistribution and fragmentation dynamics of I2 ⋯ Nen (n=2-6) clusters
Journal of Chemical Physics, Vol. 111, Núm. 1, pp. 239-244
1998
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Vibrational predissociation of the I2⋯Ne2 cluster: A molecular dynamics with quantum transitions study
Journal of Chemical Physics, Vol. 109, Núm. 15, pp. 6320-6328
1997
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Application of trajectory surface hopping to vibrational predissociation
Chemical Physics Letters, Vol. 280, Núm. 3-4, pp. 185-188
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Simulation of the photodissociation of Ar3+
Zeitschrift fur Physik D-Atoms Molecules and Clusters, Vol. 39, Núm. 4, pp. 325-331
1996
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Electron impact ionization of small argon clusters
Chemical Physics Letters, Vol. 249, Núm. 1-2, pp. 1-6
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Simulation of the Ar+3 sbsorption spectrum using molecular dynamics
Chemical Physics, Vol. 209, Núm. 2 SUPPL. 3, pp. 291-298