Publications of J. Breidung

Bernhardt, E.; Willner, H.; Kornath, A.; Breidung, J.; Bühl, M.; Jonas, V.; Thiel, W. D_3d Ground-State Structure of V(CO)₆: A Combined Matrix Isolation and Ab Initio Study of the Jahn-Teller Effect. Journal of Physical Chemistry A 2003, 107, 859–868.

Zelinger, Z.; Dréan, P.; Walters, A.; Moreno, J. R. A.; Bogey, M.; Pernice, H.; von Ahsen, S.; Willner, H.; Breidung, J.; Thiel, W.; Bürger, H. Gas-Phase Detection of the FCO₂ Radical by Millimeter Wave and High Resolution Infrared Spectroscopy Assisted by Ab Initio Calculations. Journal of Chemical Physics 2003, 118, 1214–1220.

Breidung, J.; Constantin, L.; Demaison, J.; Margulès, L.; Thiel, W. Ground State Rotational Spectrum, K=3 Splittings, Ab Initio Anharmonic Force Field and Equilibrium Structure of Trifluoroamine. Molecular Physics 2003, 101, 1113–1122.

Breidung, J.; Thiel, W. Ab Initio Study of the Charge-Transfer Complex of Xenon and Dicarbon. Journal of Molecular Spectroscopy 2002, 216, 424–427.

Jerzembeck, W.; Bürger, H.; Constantin, L.; Margulès, L.; Demaison, J.; Breidung, J.; Thiel, W. Bismuthine BiH₃: Fact or Fiction? High-Resolution Infrared, Millimeter-Wave, and Ab Initio Studies. Angewandte Chemie - International Edition 2002, 41, 2550–2552.

Jerzembeck, W.; Bürger, H.; Constantin, L.; Margulès, L.; Demaison, J.; Breidung, J.; Thiel, W. Bismutan BiH₃: Fakt oder Fiktion? Hochauflösende Infrarot-, Millimeterwellen- und Ab-Initio-Untersuchungen. Angewandte Chemie 2002, 114, 2659–2661.

Breidung, J.; Thiel, W. Equilibrium Structure and Fundamental Vibrational Wavenumbers in Monomeric Methyllithium CH₃Li: an Ab Initio Study. Journal of Molecular Structure 2001, 599, 239–254.

Beckers, H.; Bogey, M.; Breidung, J.; Bürger, H.; Demaison, J.; Dréan, P.; Paplewski, P.; Thiel, W.; Walters, A. Millimeter-Wave Spectroscopy, High Resolution Infrared Spectrum, Ab Initio Calculations, and Molecular Geometery of FPS. Journal of Molecular Spectroscopy 2001, 210, 213–223.

Lin, H.; Bürger, H.; Mkadmi, E. B.; He, S.-G.; Yuan, L.-F.; Breidung, J.; Thiel, W.; Huet, T. R.; Demaison, J. The Si–H Stretching–Bending Overtone Polyads of SiHF₃: Assignments, Band Intensities, Internal Coordinate Force Field, and Ab Initio Dipole Moment Surfaces. The Journal of Chemical Physics 2001, 115, 1378–1391.

Lin, H.; Bürger, H.; He, S.-G.; Yuan, L.-F.; Breidung, J.; Thiel, W. Overtones of the Si−H Stretching−Bending Polyad in SiHD₃: Internal Coordinate Force Field, Ab Initio Dipole Moment Surfaces, and Band Intensities. The Journal of Physical Chemistry A 2001, 105, 6065–6072.

Bürger, H.; Lecoutre, M.; Huet, T. R.; Breidung, J.; Thiel, W.; Hänninen, V.; Halonen, L. The (n00), n=3, 4, and 6, Local Mode States of H₃SiD: Fourier Transform Infrared and Laser Photoacoustic Spectra and Ab Initio Calculations of Spectroscopic Parameters. The Journal of Chemical Physics 2001, 114, 8844–8854.

Beckers, H.; Bürger, H.; Paplewski, P.; Bogey, M.; Demaison, J.; Dréan, P.; Walters, A.; Breidung, J.; Thiel, W. Millimeter-Wave Spectroscopy, High Resolution Infrared Spectrum, Ab Initio Calculations, and Molecular Geometry of FPO. Physical Chemistry Chemical Physics 2001, 3, 4247–4257.

Breidung, J.; Thiel, W. Equilibrium Structure and Spectroscopic Constants of Difluorovinylidene: An Ab Initio Study. Journal of Molecular Spectroscopy 2001, 205, 28–37.

Breidung, J.; Thiel, W. Equilibrium Structure and Fundamental Vibrational Wavenumbers in Difluorosilanone: An Ab Initio Study. Zeitschrift für anorganische und allgemeine Chemie 2000, 626, 362–367.

Beckers, H.; Bogey, M.; Breidung, J.; Bürger, H.; Dréan, P.; Paplewski, P.; Thiel, W.; Walters, A. FP=S in the Gas-Phase: Detection by Rotationally Resolved Infrared and Millimetre-Wave Spectra Assisted by Ab-Initio Calculations. Physical Chemistry Chemical Physics 2000, 2, 2467–2469.

Breidung, J.; Demaison, J.; Margulès, L.; Thiel, W. Equilibrium Structure of SiF₄. Chemical Physics Letters 1999, 313, 713–717.

Beckers, H.; Breidung, J.; Bürger, H.; Köppe, R.; Kötting, C.; Sander, W.; Schnöckel, H.; Thiel, W. Difluorosilanethione F₂Si=S by Flash Vacuum Thermolysis of (F₃Si)₂S and by Reaction of SiS with F₂ – Matrix Studies and Ab Initio Calculations. European Journal of Inorganic Chemistry 1999, No. 11, 2013–2019.

Demaison, J.; Breidung, J.; Thiel, W.; Papoušek, D. The Equilibrium Structure of Methyl Fluoride. Structural Chemistry 1999, 10, 129–133.

Breidung, J.; Bürger, H.; McNaughton, D.; Senzlober, M.; Thiel, W. Ab Initio and High Resolution Infrared Study of FCΞCBr. Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy 1999, 55, 695–708.

Breidung, J.; Thiel, W.; Gauss, J.; Stanton, J. F. Anharmonic Force Fields from Analytic CCSD(T) Second Derivatives: HOF and F₂O. The Journal of Chemical Physics 1999, 110, 3687–3696.