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Ab initio potential energy surface and vibrational frequencies of HCN

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A realistic double many-body expansion (DMBE) potential energy surface for ground-state O 3 from a multiproperty fit to ab initio calculations, and to experimental spectroscopic, inelastic scattering, and kinetic isotope thermal rate data

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Reassignment of the AlSi- photoelectron spectrum by ab initio configuration interaction calculations

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