THE EFFECT OF LARGE AMPLITUDE VIBRATIONS ON RENNER EFFECT AND SPIN-ORBIT INTERACTION IN $AH_{2}$ MOLECULES

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1972

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Ohio State University

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The theory of Renner and spin-orbit coupling has previously been applied to the limiting cases of semi-rigid bent molecules, and of linear molecules. However, recently in the analysis of the electronic spectra of PH2 and H2S+ the bent molecule approximation has been shown to be inadequate and the coupling demonstrated to be intermediate between the two cases mentioned above. A model has been developed which accounts for the effects of the large amplitude vibration on the ro-vibronic energy level pattern. Some numerical results of the application to the PH2 and H2S+ problems are presented, and the limitations of the model are discussed.

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Author Institution: School of Chemistry, University of Bristol

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