Publikationen von J. Breidung

Zeitschriftenartikel (68)

2003
Zeitschriftenartikel
Bernhardt, E.; Willner, H.; Kornath, A.; Breidung, J.; Bühl, M.; Jonas, V.; Thiel, W. D3d 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.
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
2002
Zeitschriftenartikel
Breidung, J.; Thiel, W. Ab initio study of the charge-transfer complex of xenon and dicarbon. Journal of Molecular Spectroscopy 2002, 216, 424–427.
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
2001
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
Zeitschriftenartikel
Breidung, J.; Thiel, W. Equilibrium Structure and Spectroscopic Constants of Difluorovinylidene: An ab Initio Study. Journal of Molecular Spectroscopy 2001, 205, 28–37.
2000
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
1999
Zeitschriftenartikel
Breidung, J.; Demaison, J.; Margulès, L.; Thiel, W. Equilibrium structure of SiF4. Chemical Physics Letters 1999, 313, 713–717.
Zeitschriftenartikel
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, Nr. 11, 2013–2019.
Zeitschriftenartikel
Demaison, J.; Breidung, J.; Thiel, W.; Papoušek, D. The Equilibrium Structure of Methyl Fluoride. Structural Chemistry 1999, 10, 129–133.
Zeitschriftenartikel
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.
Zeitschriftenartikel
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.
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