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Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, v.119, 2014년, pp.52 - 58
Lasorne, B. , Jornet-Somoza, J. , Meyer, H.D. , Lauvergnat, D. , Robb, M.A. , Gatti, F.
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We revisit the validity of making a direct comparison between measured absorption maxima and computed vertical transition energies within 0.1eV to calibrate an excited-state level of theory. This is illustrated on the UV absorption spectrum of ethylene for which the usual experimental values of 7.66...
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