U. Kleinekathofer et al., POTENTIALS FOR SOME RARE-GAS AND ALKALI-HELIUM SYSTEMS CALCULATED FROM THE SURFACE INTEGRAL METHOD, Chemical physics letters, 249(3-4), 1996, pp. 257-263
The van der Waals potential curves of H-2((3) Sigma), He-2, Ne-2, HeNe
, HHe, LiHe, NaHe, KHe, RbHe and CsHe have been calculated using a rec
ently derived simple: analytical formula. The repulsive potential is b
ased on exchange energies calculated from the surface integral method
applied to multielectron systems. With the exception of the long-range
dispersion coefficients, all the input parameters are atomic properti
es of the free constituent atoms. The calculated curves agree well wit
h both experimental and ab initio theoretical data.