Welcome to the WWW-page of the IUP Theoretical Spectroscopy Group

This WWW page contains results of quantum theoretical calculations by D. Maric and J. P. Burrows

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About Quantum Theoretical Calculations of Molecular Spectra

Our Objectives and Aims

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Members

Dr. Dubravko Maric, Institut für Sicherheitstechnologie, P.O. Box 101564, D-50455 Köln, Germany
Prof. Dr. John P. Burrows, Institut für Umweltphysik, P.O. Box 330440, D-28334 Bremen, Germany

Current Projects
A critical assessment of the existing and the development of new mathematical algorithms
for solving the multi-dimensional time-independent Schrödinger equation.

D. Maric and J. P. Burrows, Analysis of the UV Absorption Spectrum of ClO: A Comparative Study of Four Methods for Spectral Computations, JQSRT 62, 345-369, 1999.

You can inspect the figures (GIF) individually by visiting the following pages:
Figure 1a     Figure 1b     Figure 2a     Figure 2b     Figure 3     Figure 4a   Figure 4b

2. Here you can find computed absorption cross sections of ClO based on:

F. G. Simon, W. Schneider, G. K. Moortgat, and J. P. Burrows, J. Photochem. Photobiol. A: Chem. 55, 1-23, 1990.
J. A. Coxon and D. A. Ramsay, Can. J. Phys. 54, 1034-1042, 1976.
J. A. Coxon, W. E. Jones, and E. G. Skolnik, Can. J. Phys. 54, 1043-1052, 1976.

You can download the table (ASCII) by clicking on the following link:
Table1

D. Maric, J. P. Burrows, and G. K. Moortgat, A Study of the Formation of N₂O in the Reaction of NO₃(A²E') with N₂, J. Atmos. Chem. 15, 157-169, 1992.

D. Maric and J. P. Burrows, Formation of N₂O in the Photolysis/Photoexcitation of NO, NO₂ and Air, J. Photochem. Photobiol. A: Chem. 66, 291-312, 1992.

D. Maric, J. P. Burrows, A. Meller, and G. K. Moortgat, A Study of the UV-Visible Absorption Spectrum of Molecular Chlorine, J. Photochem. Photobiol. A: Chem.70, 205-214, 1993. (see Cl2.gif and Cl2_Schneider.gif)

D. Maric, J. P. Burrows, and G. K. Moortgat, A Study of the UV-Visible Absorption Spectra of Br₂ and BrCl, J. Photochem. Photobiol. A: Chem. 83, 179-192, 1994. (see BrCl.gif)

D. Maric and J. P. Burrows, Application of a Gaussian Distribution Function to Describe Molecular UV-Visible Absorption Continua. 1. Theory, J. Phys. Chem. 100, 8645-8659, 1996.

D. Maric, J. Crowley, and J. P. Burrows, Application of a Gaussian Distribution Function to Describe Molecular UV-Visible Absorption Continua. 2. The Spectra of RO₂ Radicals, J. Phys. Chem. A 101, 2561-2567, 1997.

D. Maric and J. P. Burrows, Analysis of the UV Absorption Spectrum of ClO: A Comparative Study of Four Methods for Spectral Computations, JQSRT 62, 345-369, 1999.