V. Aquilanti et al., SCATTERING OF ALIGNED MOLECULES - THE POTENTIAL-ENERGY SURFACES FOR THE KR-O-2 AND XE-O-2 SYSTEMS, The Journal of chemical physics, 109(10), 1998, pp. 3898-3910
Total integral cross sections-for scattering of oxygen molecules on kr
ypton and xenon atoms were measured in the thermal energy range, as a
function of the collision energy and under a controlled alignment of t
he rotational angular momentum of the molecules [Aquilanti er nl., Nat
ure, 371, 399 (1994)]. Data obtained with a ''hot'' effusive molecular
beam, which contains fast rotating and randomly oriented O-2 molecule
s, mainly probe the spherical component of the potential energy surfac
es. Experiments with supersonic seeded beams, where the oxygen molecul
es are cooled at the K = 1 rotational level and selectively aligned [A
quilanti et nl., Phys. Rev. Lett. 74, 2929 (1995)], probe the anisotro
py of the potential energy surfaces. The analysis of the experimental
results, based upon close-coupling exact quantum mechanical calculatio
ns of the cross sections, provides an accurate characterization of the
interactions at intermediate and large intermolecular distances for t
he Kr-O-2 and Xe-O-2 systems. It is found that the most stable configu
ration of the two complexes is for perpendicular approach of the rare
gas atom, with energies 15.84 for Kr and 17.87 meV for Xe, at intermol
ecular distances of 3.72 and 3.87 Angstrom, respectively. An adiabatic
approximation and a semiclassical description Shed light on some gene
ral features of the collision dynamics of aligned molecules, in partic
ular on the observed effects of the interaction anisotropy on the glor
y interference phenomenon. (C) 1998 American Institute of Physics. [S0
021-9606(98)00334-1].