Tp. Softley et Aj. Hudson, MULTICHANNEL QUANTUM-DEFECT THEORY SIMULATION OF THE ZERO-KINETIC-ENERGY PHOTOELECTRON-SPECTRUM OF H-2, The Journal of chemical physics, 101(2), 1994, pp. 923-928
The multichannel quantum defect theory (MQDT) is applied to the simula
tion of the upsilon(+)=2 band of the zero-kinetic-energy (ZEKE) photoe
lectron spectrum of molecular hydrogen and also to the photoionization
spectrum involving autoionizing Rydberg states in the region between
the upsilon(+)=1 and upsilon(+)=2 thresholds. The results of the calcu
lations are compared with previously reported experimental results [J.
Chem. Phys. 96, 4149 (1992)]. The calculations are in very good agree
mentwith experiment and provide quantitative confirmation of the previ
ously proposed mechanisms for intensity perturbation.