Ia. Godunov et al., Potential functions of inversion of carbonyl compound molecules in the lower excited electronic states, RUSS J PH C, 73(11), 1999, pp. 1806-1812
The potential functions of the inversion of carbonyl compound molecules (al
l molecules for which necessary experimental data were available) were dete
rmined for the lower excited S-1 and T-1 electronic states with the use of
various approximations. In addition to the model potentials with polynomial
and Gauss-type barriers used earlier, calculations for Lorentz-type barrie
rs were performed. The calculation results were analyzed to select the most
reliable inversion potential functions for all molecules under study.