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Izvestiya of Saratov University. Physics, 2006, Volume 6, Issue 1, Pages 41–59
DOI: https://doi.org/10.18500/1817-3020-2006-6-1-2-41-59
(Mi isuph449)
 

Physics

Vibronic spectra and structure of exited states of polyatomic molecules

G. N. Tena, T. G. Burovaa, V. I. Baranovb

a Saratov State University
b Vernadsky Institute of Geochemistry and Analytical Chemistry of RAS
References:
Abstract: The methods of determination of molecular model parameters in exited electronic states are considered. Structural-dynamic models polyatomic molecules are developed using a semi-empirical method of hybridized atomic orbitals. It is shown that the electronic-vibrational spectra make it possible to identify the tautomeric forms in different phases states, taking into account the intermolecular interaction.
Keywords: molecular modeling, electronic-vibrational spectra.
Received: 07.07.2006
Document Type: Article
UDC: 539.194
Language: Russian
Citation: G. N. Ten, T. G. Burova, V. I. Baranov, “Vibronic spectra and structure of exited states of polyatomic molecules”, Izv. Sarat. Univ. Physics, 6:1 (2006), 41–59
Citation in format AMSBIB
\Bibitem{TenBurBar06}
\by G.~N.~Ten, T.~G.~Burova, V.~I.~Baranov
\paper Vibronic spectra and structure of exited states of polyatomic molecules
\jour Izv. Sarat. Univ. Physics
\yr 2006
\vol 6
\issue 1
\pages 41--59
\mathnet{http://mi.mathnet.ru/isuph449}
\crossref{https://doi.org/10.18500/1817-3020-2006-6-1-2-41-59}
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