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- W2030798935 abstract "Abstract The electronic ground state of Ne+3 is studied by multireference configuration interaction calculations. This includes the computation of potential energy surfaces for C∞v and C2v geometries and potential energy curves for the diatomic ion Ne+2 (2Σ+u). In contrast to the situations for He+3 and Ar+3, the Ne+3 trimer is found only to be metastable in its symmetric collinear configuration D∞h and associated state 2Σ+u. Slightly deeper energy minima exist for asymmetrical collinear and for C2v geometries, both corresponding to a neutral Ne atom bound by polarization forces to the charged dimer Ne+2. Similar to the other rare gas trimer ions, on a large range of internuclear separations different configurations are separated by only relatively small energy differences leading to the rather floppy structure that is characteristic for these systems." @default.
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- W2030798935 date "1993-11-01" @default.
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- W2030798935 title "The ground state geometry of the Ne+3 trimer" @default.
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- W2030798935 doi "https://doi.org/10.1016/0009-2614(93)89265-j" @default.
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