Recursive Evaluation of Some Atomic Integrals

Abstract

A simple recursion scheme is set up for the higher derivatives of functions of the form ${\mathrm{f(\alpha ,\beta )(\alpha +\beta )}}^{\text{−1}}$ and ${\mathrm{f(\alpha ,\beta ,\gamma )(\alpha +\beta +\gamma )}}^{\text{−1}}$ and applied to the rapid calculation of the Calais‐Löwdin two‐particle atomic integrals.