|
76. POPLE PI: Pople Pi-Electron Program
by T. Janiszewski, Illinois Institute of Technology, Chicago, Illinois 60616 Complete program will perform Hückel, closed-shell SCF, and open-shell SCF calculations on pi-electron systems. FORTRAN IV (IBM 7040) Lines of Code: 800 Recommended Citation: T. Janiszewski, QCPE 11, 76 (1966). |