Theoretical model of infrared spectra of hydrogen bonds in molecular crystals of 2-thiopheneacetic acid: Fermi resonance and Davdov coupling effects.
A quantum theoretical approach, within the adiabatic approximation and taking into account a strong non-adiabatic correction via the resonant exchange between the fast mode excited states of the two moieties of the dimer. The intrinsic anharmonicity of the low-frequency mode through a Morse potentia...
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| Hauptverfasser: | , , , , |
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| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
Society of Chemists and Technologists of Macedonia
2016-12-01
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| Schriftenreihe: | Macedonian Journal of Chemistry and Chemical Engineering |
| Schlagworte: | |
| Online-Zugang: | https://mjcce.org.mk/index.php/MJCCE/article/view/1081 |
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