PSEUDO-POTENTIAL MCSCF STUDY OF THE $X^{1}\Sigma^{+}_{g}$ AND $D^{1}\Sigma^{+}_{u}$ STATES OF THE $I_{2}$ MOLECULE

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1976

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Ohio State University

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Motivated by the laser prospects of the I2-system, we have carried out an accurate study of the states X1Σg+ and D1Σu+ using the pseudopotentia1 MCSGF method. The spectroscopic data and transition moment data are presented.

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Author Institution: Chemistry Division, Argonne National Laboratory

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http://hdl.handle.net/1811/9817

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Abstracts of OSU International Symposium on Molecular Spectroscopy 1970-1979