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PMO-RKR-van der Waals potential energy curves for the X1Σ+ and A1Σ+ states of the isotopic lithium hydrides

✍ Scribed by A. Pardo; J.J. Camacho; J.M.L. Poyato


Publisher
Elsevier Science
Year
1986
Tongue
English
Weight
935 KB
Volume
108
Category
Article
ISSN
0301-0104

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✍ I Borges Jr.; P.J.S.B Caridade; A.J.C Varandas 📂 Article 📅 2001 🏛 Elsevier Science 🌐 English ⚖ 162 KB

We report new potential energy curves for the X 1 + and A 1 states of the CO molecule by employing the realistic extended Hartree-Fock approximate correlation energy model for diatomics with inclusion of the united-atom limit (EHFACE2U). Special care has been taken to describe the A 1 potential maxi