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Diagonal-corrected vibrational adiabatic hyperspherical

Romelt, J. (1983). Prediction and interpretation of collinear reactive scattering resonances by the diagonal corrected vibrational adiabatic hyperspherical model, Chem. Phys. 79, 197-209. [Pg.403]

To clarify these questions we have studied the quantal and semiclassical theory of reactive resonances. In section II the Diagonal corrected Vibrational Adiabatic Hyperspherical (DIVAH) model 21, ) is reviewed. This theory was the first to provide quantitative predictions (with a typical accuracy of 0.1 kcal/mole) of collinear quantal resonance energies. Furthermore the DIVAH model led us to the new and very surprising phenomenon of vibrationally bonded molecules (29-41). The connection and interrelation with semiclassical RPO theory (25.30.42-47) which predicted and interpreted these results, is presented in section III. Having... [Pg.354]


See other pages where Diagonal-corrected vibrational adiabatic hyperspherical is mentioned: [Pg.88]    [Pg.88]    [Pg.386]    [Pg.81]   


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Adiabatic correction

Diagonal

Diagonal-corrected vibrational

Diagonalization

Hypersphere

Hyperspheres

Hyperspherical

Vibrational corrections

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