Basis Functions forAb InitioCalculations

A compilation and basis function analysis are given for existing ab initio molecular eigenfunctions in which a direct solution of the Schrodinger equation is attempted and all integrals are rigorously evaluated; thus, calculations using Mulliken integral approximations or electrostatic models are omitted. The survey is also limited to molecular wave functions that involve more than two electrons and employ one-electron basis orbitals. (D.L.C.)