A. Bonechi et al., INTERACTION-INDUCED POLARIZABILITY INVARIANTS AND THE INTERATOMIC POTENTIAL OF THE MERCURY DIATOM, The Journal of chemical physics, 109(14), 1998, pp. 5880-5885
Analytical models of the invariants (trace and anisotropy) of the diat
om polarizability tensor are formulated that differ from existing mode
ls by the suppression of the classical long-range components at close
range (''damping''). Such damping is imperative in diatomic systems wh
ere the long-range polarizability terms are relatively large and/or th
e collision energies are high so that substantial penetration of the e
lectronic shells of the colliding atoms takes place, e.g., for collisi
on-induced light scattering by mercury vapor at high temperatures. Whe
n a small number of physically meaningful parameters of the polarizabi
lity models are properly adjusted, the binary trace and anisotropy col
lision-induced spectra of mercury vapor are closely reproduced from th
eory in all details. An improved model. of the Hg-Hg interaction poten
tial, which reproduces the existing: bound mercury dimer slates as wel
l as the viscosity data, includes a similar damping term fur suppressi
on of the dispersion part at close range. (C) 1998 American Institute
of Physics.