Prof. Dr. Michael Thoss

Profil

Derzeitige StellungProfessor W-3 und Äquivalente
FachgebietTheoretische Chemie: Elektronenstruktur, Dynamik, Simulation,Theoretische Physik der Kondensierten Materie
Keywordsa) nonadiabatic dynamics, b) semiclassical methods, c) dissipative systems, d) electron-molecule scattering (ASB 07.00)

Aktuelle Kontaktadresse

LandDeutschland
OrtFreiburg
Universität/InstitutionAlbert-Ludwigs-Universität Freiburg
Institut/AbteilungPhysikalisches Institut

Gastgeber*innen während der Förderung

Prof. Dr. William H. MillerDepartment of Chemistry, University of California, Berkeley, Berkeley
Beginn der ersten Förderung16.07.1998

Programm(e)

1998Feodor Lynen-Forschungsstipendien-Programm

Publikationen (Auswahl)

2001Michael Thoss, H. Wang, W.H. Miller: Generalized Forward-Backward Initial Value Representation for the Calculation of Correlation Functions in Complex Systems. In: J. Chem. Phys. , 2001, 9220
2001Michael Thoss, H. Wang, W.H. Miller: Self-Consistent Hybrid Approach for Complex Systems: Application to the Spin-Boson Model with Debye Spectral Density. In: J. Chem. Phys. , 2001, 2991
2001R. Gelabert, X. Gimenez, Michael Thoss, H. Wang, W.H. Miller: Semiclassical Description of Diffraction and Its Quenching by the Forward-Backward Version of the Initial Value Representation. In: J. Chem. Phys. , 2001, 2572
2001H. Wang, Michael Thoss, K. Sorge, R. Gelabert, X. Gimenez, W.H. Miller: Semiclassical Description of Quantum Coherence Effects and Their Quenching: A Forward-Backward Initial Value Representation Study. In: J. Chem. Phys., 2001, 2562
2001H. Wang, Michael Thoss, W.H. Miller: Systematic Convergence in the Dynamical Hybrid Approach for Complex Systems: A Numerically Exact Methodology. In: J. Chem. Phys. , 2001, 2979
2000R. Gelabert, X. Gimenez, Michael Thoss, H. Wang, W.H. Miller: A Log-Derivative Formulation of the Prefactor for the Semiclassical Herman-Kluk Propagator. In: J. Phys. Chem., 2000, 10321
2000H. Wang, Michael Thoss, W.H. Miller: Forward-Backward Initial Value Representation for the Calculation of Thermal Rate Constants for Reactions in Complex Molecular Systems. In: J. Chem. Phys., 2000, 47
2000Michael Thoss, W.H. Miller, G. Stock: Semiclassical Description of Nonadiabatic Quantum Dynamics: Application to the S1-S2 Conical Intersection in Pyrazine. In: J. Chem. Phys. , 2000, 10282