Wave Functions for the Free Electron. II. The Inclusion of Polarization and Exchange
- 1 September 1961
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 123 (5) , 1718-1723
- https://doi.org/10.1103/physrev.123.1718
Abstract
The effect of the polarization of the atomic core by the free electron on the free-electron wave function and the effect of the exchange of the free electron with the bound orbitals on this wave function are treated by perturbation theory. Polarization must be considered first. Its effect on the atomic charge cloud is introduced through an expansion over the bound wave functions for the atom in terms of the free-electron separation as a parameter. This parametric treatment of electron separation means we cannot accept the solution at small separations from the nucleus although this is not a serious restriction. From this wave function we obtain a polarized Coulomb potential from which a solution for the free-electron function may be obtained using our old programs. Having solved the free-electron wave equation with the exchange potential terms supposed zero, we use this solution to compute the exchange integrals. The equation including these integrals is then solved to obtain approximate wave functions for free electrons containing both exchange and polarization.Keywords
This publication has 17 references indexed in Scilit:
- Electron Scattering by Noble Gases in the Limit of Zero EnergyPhysical Review B, 1959
- Elastic Scattering of Low-Energy Electrons by ArgonPhysical Review B, 1959
- A Note on the Scattering of Electrons from Atomic HydrogenPhysical Review B, 1959
- Wave Function for the Free Electron. I. The Coulomb PotentialPhysical Review B, 1959
- Slow-Electron Scattering by Atomic OxygenPhysical Review B, 1959
- Interaction of Slow Electrons with Atomic Oxygen and Atomic NitrogenPhysical Review B, 1958
- Polarization and Exchange Effects in the Scattering of Electrons from Atoms with Application to OxygenPhysical Review B, 1957
- Low-Energy Elastic Scattering of Electrons by Oxygen and NitrogenJournal of Applied Physics, 1957
- The Hartree-Fock equations for continuous states with applications to electron excitation of the ground configuration terms of O IPhilosophical Transactions of the Royal Society of London. Series A, Mathematical and Physical Sciences, 1953
- A Simplification of the Hartree-Fock MethodPhysical Review B, 1951