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Covalent-ionic nature of the potential energy surface of the Li-CO2complex

✍ Scribed by Federico Moscardó; Emilio San -Fabián


Book ID
104794239
Publisher
Springer
Year
1986
Tongue
English
Weight
262 KB
Volume
70
Category
Article
ISSN
1432-2234

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The potential energy surface for the electronic ground state of CO 2 is refined by means of a two-step variational procedure using the exact rovibrational Hamiltonian in the bond length-bond angle coordinates. In the refinement, the observed rovibrational energy levels for J = 0-4 below 16,000 cm -1