|
83. ERSPEC:First-Order Electron Spin Resonance
Spectra
by Charles S. Johnson, Jr., modified by M. K. Ahn, Yale University, New Haven, Connecticut 06520 This program calculates first-order ESR spectra as described in R. Chang and C. S. Johnson, Jr., J. Chem. Phys., 41, 3272 (1964). Line positions and intensities are determined from assumed splitting constants, and then absorption, first-derivative or second-derivative spectra are calculated and/or plotted using either Gaussian or Lorentzian components. The program may be used with an EAI 3400 plotter to obtain plots of results, or the plotting may be omitted. FORTRAN IV (IBM 7090) Lines of Code: 550 Recommended Citation: M. K. Ahn, QCPE 11, 83 (1966). |