Features of the electronic potential energy surfaces of nitric acid below 7 eV

@inproceedings{Bai1990FeaturesOT,
  title={Features of the electronic potential energy surfaces of nitric acid below 7 eV},
  author={Yong Yan Bai and Gerald A. Segal},
  year={1990}
}
Large scale configuration interaction calculations have been carried out for the potential energy surfaces of the four lowest singlet states of nitric acid along the dissociation paths leading to OH (X 2Π) and NO2 in its ground X 2A1 and B 2B1 states. In order to gain a detailed picture of the dissociation dynamics, correlations are drawn between the forces experienced by these species upon photodissociation and observed oscillator strengths, vector coupling parameters, relative Λ doublet… CONTINUE READING

Citations

Publications citing this paper.