Spectroscopic constants of diatomic molecules computed correcting Hartree-Fock or general-valence-bond potential-energy curves with correlation-energy functionals.
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Biomedical subjects
E San-Fabián
Publications and source records attributed to E San-Fabián.
Density-functional formalism and the two-body problem.
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Calculation of H-H potential energies and fusion rates in PdxH2 clusters (x=2,4).
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Possibility of finding reliable solid-state tight-binding parameters for the Si-N bond through quantum-chemistry calculations.
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