Abstract
A combined method for solving the inverse electrooptical problem was considered using as examples 36 organic compounds for which the absolute band intensities in their IR absorption spectra were known. Data from quantum-chemical calculations were used to find the initial values of the electrooptical parameters; experimental data for the absolute band intensities, to determine the final values. It was shown that the previously observed locality of the parameters and their transfer into a series of related molecules were confirmed by direct calculations.
Published Version
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