THIS INFORMATION IS OBSOLETE AND IS PROVIDED ONLY FOR ITS HISTORICAL VALUE

by Noel J. Fitzpatrick, Department of Chemistry, University College, Belfield, Dublin, Ireland

The program performs self-consistent charge and configuration calculations on inorganic molecules. The input and output metal charge and configuration, along with such other information as the AO population matrix and ligand populations per matrix, are printed after each cycle. Finally, when convergence has occurred or when all the cycles requested have been completed, the overlap matrix (S), the resonance matrix (H), the eigenvectors are also punched as they are useful as input to other programs.

FORTRAN IV (IBM 360/50) Lines of Code: 795 Recommended Citation: N. J. Fitzpatrick, QCPE 11, 193 (1971).