It is shown that a refinement of a model for predicting polyatomic vibrational overtone spectra has advantages with respect to conventional normal mode theory in accounting for the spectra (including overtone and combination bands) of “large” molecules such as 235UF6 and 238UF6.
J. Bron and R. Wallace, J. Chem. Soc., Faraday Trans. 2, 1978, 74, 611 DOI: 10.1039/F29787400611
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