Search Results - "Érman, E. A."

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    Quantum chemical calculation of normal molecular vibrations for substituted five-member chalcogen heterocyclic compounds taking anharmonicity into account by Élkin, P. M., Érman, E. A., Pulin, O. V.

    Published in Journal of applied spectroscopy (01-03-2009)
    “…The DFT/B3LYP/6-31G* method is used in an anharmonic approximation to analyze the vibrational spectra of substituted furan, thiophene, and selenophene (3,4-…”
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    Journal Article
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