|
258. ISOTOPE EFFECTS V-I
by Warren E. Buddenbaum, Department of Chemistry, Indiana University, Bloomington, Indiana 47405 This program calculates the vibrational frequencies, the mass dependent factor of a partition function, ratios of isotopic partition functions, and ratios of isotopic partition functions for molecules up to twelve atoms and thirty-six internal coordinates. FORTRAN IV (CDC 6000) Lines of Code: 1562 Recommended Citation: W. E. Buddenbaum, QCPE 11, 258 (1974). |