Selected Publications
from the Theoretical Chemistry Group at the University of Heidelberg
This is a highly selective handmade list of references. It relates to the list of research areas. Click the numerator in front of a paper to view the corresponding research area.
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[1] L.S. Cederbaum, W. Domcke, J. Schirmer and W. von Niessen, Adv. Chem. Phys. 65 (1986) 115
Correlation effects in the ionization of molecules: Breakdown of the molecular orbital picture
[2] J.Schirmer, A.B. Trofimov, K.J. Randall, J. Feldhaus, A.M. Bradshaw, Y. Ma, C.T. Chen and F. Sette, Phys. Rev. A 47 (1993) 1136
K-Shell excitation of water, ammonia, and methane molecules using high-resolution photoabsorption spectroscopy
[3] F. Tarantelli, A. Sgamellotti and L.S. Cederbaum,
in: Applied Many-Body Methods in Spectroscopy and Electronic Structure (Plenum, N.Y., 1992)
Recent developments in the calculation of molecular Auger spectra
[4] J. Schirmer, L.S. Cederbaum and O. Walter, Phys. Rev. A 28 (1983) 1237
A new approach to the one-particle Greens function for finite Fermi systems
[5] J. Schirmer, Phys.Rev. A 43 (1991) 4647
Closed-form intermediate representations of many-body propagators and resolvent matrices
[6] H. Köppel, L.S. Cederbaum, W. Domcke and S.S. Shaik, Angew. Chemie 95 (1983) 221
Symmetriebrechung und Nicht-
[7] H. Köppel, W. Domcke and L.S. Cederbaum, Adv. Chem. Phys. 57 (1984) 59
Multi-mode molecular dynamics beyond the Born-Oppenheimer approximation
[8] T. Pacher, L.S. Cederbaum and H. Köppel, Adv. Chem. Phys. 84 (1993) 293
Adiabatic and quasidiabatic states in a gauge theoretical framework
[9] H.-D. Meyer, Phys. Rev. A 34 (1986) 1797
Electron-molecule scattering treated with the use of separable approximations for the nonlocal part of the interaction: Static exchange calculations for e− + H2 and e− + N2
[10] H.-D. Meyer, Phys. Rev. A 40 (1989) 5605
Optical potentials for electron-molecule scattering: A comparative study on the N2 2PIg resonance
[11] H. W. Domcke, C. Mündel and L.S. Cederbaum, Comments At. Mol. Phys. 20 (1987) 293
Collisions dynamics with non-local complex potentials;
H.J. Korsch, H. Kutz and H.-D. Meyer, Theory. J. Phys. B 20 (1987) L 433
Rotational rainbows in electron-molecule scattering;
S.V.K. Kumar, G. Ziegler, H.J. Korsch, K. Bergmann and H.-D. Meyer, Phys. Rev. A 44 (1991) 268
Inelastic transition in vibrationally excited Na2 induced by intermediate energy electron impact
[12] J. Schirmer, M. Braunstein and V. McKoy, Phys. Rev. A 41 (1990) 283
Molecular K-shell photoionization cross sections in the relaxed-core Hartree-Fock approximation
[13] K. Zähringer, H.-D. Meyer and L.S. Cederbaum, Phys. Rev. A 46 (1992) 5643
Angular resolved Auger rates of LiF and HF
[14] U. Manthe and H. Köppel, J. Chem. Phys. 93 (1990) 1658
Dynamics on potential energy surfaces with conical intersections: Adiabatic, intermediate and diabatic behavior;
U. Manthe, H. Köppel and L.S. Cederbaum, J.Chem. Phys. 95 (1992) 1708
Dissociation and predissociation on coupled potential energy surfaces: A three-dimensional wave packet dynamical study
[15] H.-D. Meyer, U. Manthe and L.S. Cederbaum, Chem. Phys. Lett. 165 (1990) 73
The multi-configurational time-dependent Hartree approach;
U. Manthe, H.-D. Meyer and L.S. Cederbaum, J. Chem. Phys. 97 (1992) 3199
Wave packet dynamics within the multi-configuration Hartree framework: General aspects and application to NOCl;
U. Manthe, H.-D. Meyer and L.S. Cederbaum, J. Chem. Phys. 97 (1992) 9062
Multi-configurational time-dependent Hartree study of complex dynamics: photodissociation of NO2
[16] P. Schmelcher and L.S. Cederbaum, Z. Phys. D 24 (1992) 311
Regularity and chaos in the center of mass motion of the hydrogen atom in a magnetic field
[17] P. Schmelcher, L.S. Cederbaum and U. Kappes,
in: Conceptual Trends in Quantum Chemistry (Kluver, NY, 1993)
Molecules in magnetic fields: fundamental aspects
[18] Th. Zimmermann, L.S. Cederbaum, H.-D. Meyer and H. Köppel, J. Phys. Chem. 91 (1987) 4446
Statistical Properties of Energy Levels
[19] P. Fischer, H. Köppel und L.S. Cederbaum, Z. Physik B 74 (1989) 513;
Synth. Metals 41-43 (1991) 3597
[20] M. Yu. Lavrentiev, H. Köppel and M. Böhm, Chem. Phys. 169 (1993) 85
[21] H.-G. Weikert, L.S. Cederbaum, F. Tarantelli, A.I. Boldyrev, Z. Phys. D: Atoms, Molecules and Clusters 18 (1991) 299;
M.K. Scheller, L.S. Cederbaum, J. Phys. B: At. Mol. Opt. Phys. 25 (1992) 2257;
J. Chem. Phys. 99 (1993) 441
[22] T. Sommerfeld, M.K. Scheller, L.S. Cederbaum, Chem. Phys. Lett. 209 (1993) 216;
J. Chem. Phys. 98 (1994) 8914;
M.K. Scheller, L.S. Cederbaum, J. Chem. Phys. 100 (1994) 8934, 8943;
ibid. 101 (1994) 3962
[23] U. Kappes and P. Schmelcher, Physics Letters A 210 (1996) 409
On the topology of adiabatic electronic potential energy surfaces in a strong magnetic field
[24] P. Schmelcher and L.S. Cederbaum,
in: Atoms and Molecules in Intense Fields (Springer Series): Structure and Bonding 86 (1996) 27
Two Interacting Charged Particles in Strong Static Fields: A Variety of Two-Body Phenomena