Exact treatment of the vibrational isoto
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Tomislav P. ลฝivkoviฤ
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Article
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2009
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Elsevier Science
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English
โ 413 KB
Mathematical formalism of the Low Rank Perturbation (LRP) method can be applied to analyze vibrational isotope effect of arbitrary (non-planar) molecules. In LRP this effect is treated within the harmonic approximation and under assumption that force field does not change due to isotopic substitutio