The effect of the breakdown of the Born-Oppenheimer approximation on the rotation-vibration Hamiltonian of a triatomic molecule
β Scribed by P.R. Bunker; R.E. Moss
- Publisher
- Elsevier Science
- Year
- 1980
- Tongue
- English
- Weight
- 894 KB
- Volume
- 80
- Category
- Article
- ISSN
- 0022-2852
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π SIMILAR VOLUMES
A method for using a single Kindependent grid for problems where otherwise a basis of associated Legendre functions or the corresponding K-dependent grids would be employed, specific&y for calculating the rotational-vibrational energy Ievels of a triatomic molecule, has been described and tested. K
Evidence demojhstsating an explicit nuclear coordinate dependence bf efectr&c matrix e&&s in the tran&ion \_ moment for phosphorescence to the ground state'vibration~ maRifofd has been found for substituted benzenes by an opticaliy detected microwave double resonance esperimen:. Theoretical expressi