C. Illescas et al., CLASSICAL DESCRIPTION OF IONIZATION IN HE2++H COLLISIONS, Journal of physics. B, Atomic molecular and optical physics, 30(7), 1997, pp. 1765-1784
We report a study on electronic distributions obtained from a CTMC tre
atment of the He2+ + H reaction, which may be used as criteria to impr
ove the quality of pseudostates within the framework of close-coupling
molecular methods. By using the concept of molecular energy of classi
cal electrons, an analysis of the mechanism at intermediate energies c
onfirms that at low nuclear velocities a sizeable part of the ionizing
cloud could be transiently described by bound molecular wavefunctions
, at small internuclear distances. However, the description of the ion
ization process is incomplete and worsens considerably at velocities l
arger than the maximum of the ionization cross section. Hence, pseudos
tates are indispensable for representing the evolution of the ionizing
cloud, for the whole energy range. The dominant mechanisms in the cla
ssical description of ionization are illustrated at velocities close t
o the maximum of the cross section. The so-called saddle-point ionizat
ion mechanism is seen to correspond to the threshold behaviour of the
so-called soft electrons in high-energy treatments. From a study of ou
r data, some desirable (and unusual) general properties of the pseudos
tates are obtained.