COMPUTER-CALCULATED ROTATIONAL CONTOURS OF VIBRONIC BANDS IN TRIPLET-SINGLET TRANSITIONS

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1973

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Ohio State University

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Abstract

A number of programs are available for calculating the rotational contours of vibronic bands in singlet-singlet transitions. A program has been developed to do the same for triplet-singlet transitions. The capabilities and limitations of the program will be discussed and illustrated with examples of its application to the elucidation of the excited state structure of some simple molecules.

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Author Institution: Department of Chemistry and Biochemistry, Southern Illinois University

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