ELECTRONIC-SPECTRA OF THE OH(A(2)SIGMA(+))-H-2 AND OH(A(2)SIGMA(+))-D-2 COMPLEXES
The electronic spectra for the OHH2 and OHD2 complexes have been predicted from first principles. Our method relies on high quality ab initio calculations of a minimum energy path and adiabatic separation of the bending vibrational modes. The model allows a simple interpretation and tentative assign...
Main Authors: | Hernandez, R, Clary, D |
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Format: | Journal article |
Language: | English |
Published: |
1995
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