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Understanding the adiabatic approximation; the accurate data of H2 transferred to H3(+)

Hinze J., Alijah A., Wolniewicz L.

Polish Journal of Chemistry

1998

Vol. 72, nr 7S

1293-1303

Different ab initio calculations of the rotation-vibrational states of H3(+) and its isotopomers are reviewed. In the critical discussion of the results obtained by various authors, we have attempted to analyse the origin of the slight differences remaining (i) due to the inadequacies in the potential surface or (ii) due to the adiabatic approximation used.