PREDICTIONS OF THE HYPERFINE STRUCTURE OF THE $Cs_{2} 0^{-}_{g}$ LONG-RANGE MOLECULAR STATE DISSOCIATING INTO $Cs(6s^{2}S_{1/2})+Cs(6p^{2}P_{3/2})$

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1998

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Ohio State University

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The bound long-range Cs20g state dissociating into Cs(6s2S1/2)+Cs(6p2P3/2) and correlated at smaller distances to the slightly bound (1)3Πg state was predicted in 1985 [1] to have a well depth of ∼76cm−1 at an equilibrium internuclear separation of ∼26a0. In this previous work, we approximated the interaction energy via the usual multipolar expansion up to R−8 and we neglected both exchange and overlap effects. Considering the LeRoy [2] or modified LeRoy criteria [3], it appears that such approximations can be considered as valid for RL>26a0 or RML>23a0. Then inner turning points of the potential are at internuclear separations for which exchange and overlap effects have to be considered. Here we have improved our description of the potential including these two contributions and using more accurate values for the expansion coefficients Cn. We have also extended our work to the predictions of the hyperfine structure of the Cs20g state by considering basis functions describing atomic hyperfine structure.

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Reference [1] B. Bussery and M. Aubert-Fr'{e}con J. Mol. Spect 113 21 (185) [2] R.J. LeRoy Can. J. Phys. 52 246 (1974) [3] B. Ji, C.C. Tsai and W.C. Stwalley Chem. Phys. Lett. 236 242 (1995)


Author Institution: Laboratoire de Spectrom'{e}trie Ionique et Mol'{e}culaire UMR 5579, B^{a}t. 205, 43 Bd du 11 Novembre 1918; Laboratoire de Physique Mol'{e}culaire et des Collisions, B^{a}t. 205, 43 Bd du 11 Novembre 1918; Laboratoire de Spectrom'{e}trie lonique et Mol'{e}culaire UMR 5579, B^{a}t. 205, 43 Bd du 11 Novembre 1918

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