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Izvestiya of Saratov University. Physics, 2011, Volume 11, Issue 1, Pages 20–25
(Mi isuph95)
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This article is cited in 4 scientific papers (total in 4 papers)
Physics
Angarmonic shift of lines in modelling calculations of vibrational spectra for carbonic acid dimer with hydrogen bond
M. D. Elkina, L. M. Babkovb a Yuri Gagarin State Technical University of Saratov
b Astrakhan State University
Abstract:
Using by DFT/B3LYP methods scheme of value for angarmonic shift of vibrational lines in carbonic acid monomer and dimmer is described.
Keywords:
carbonic acid dimer, adiabatic potential, anharmonic shift, hydrogen bond.
Citation:
M. D. Elkin, L. M. Babkov, “Angarmonic shift of lines in modelling calculations of vibrational spectra for carbonic acid dimer with hydrogen bond”, Izv. Sarat. Univ. Physics, 11:1 (2011), 20–25
Linking options:
https://www.mathnet.ru/eng/isuph95 https://www.mathnet.ru/eng/isuph/v11/i1/p20
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Abstract page: | 42 | Full-text PDF : | 3 | References: | 12 |
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