AUTOMATIC COMPUTATION OF ROTATIONAL ENERGIES, WAVE FUNCTIONS, FREQUENCIES, AND STARK EFFECTS FOR ASYMMETRIC ROTORS.
Creators:Brooks, W. V. F.
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Publisher:Ohio State University
Using Wang function representations, the energy levels are determined by diagonalizing four relatively small symmetric matrices (order J/2) for each J value. The eigenfunctions are available from the diagonalization, and they are used to calculate the Stark perturbations. The programs are written in FORTRAN II and can be used on many small computers.
Author Institution: Department of Chemistry, Ohio University
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