Computation of molecular integrals over Slater type orbitals. II. Calculation of electric multipole moment integrals using translation formulas
Özet
Analytical expressions through the overlap integrals are derived for the electric multipole moment integrals over Slater type orbitals. These formulas can be used for the calculation of the 2(nu)-pole electric moments of a molecule in the Hartree-Fock-Roothaan approximation. (C) 1999 Elsevier Science B.V. All rights reserved.