Zobrazeno 1 - 10
of 3 420
pro vyhledávání: '"Vibronic spectroscopy"'
Publikováno v:
Molecules, Vol 28, Iss 12, p 4702 (2023)
Fluorinated organic compounds have superior physicochemical properties than general organic compounds due to the strong C-F single bond; they are widely used in medicine, biology, pesticides, and materials science. In order to gain a deeper understan
Externí odkaz:
https://doaj.org/article/03d68e1f3896440bbe1a77778f2bb915
Autor:
Fabrizio Santoro, Javier Cerezo
Publikováno v:
Journal of Computational Chemistry. 44:626-643
We introduce FCclasses3, a code to carry out vibronic simulations of electronic spectra and nonradiative rates, based on the harmonic approximation. Key new features are: implementation of the full family of vertical and adiabatic harmonic models, vi
Publikováno v:
Frontiers in Chemistry, Vol 8 (2020)
Over the last decade, molecules capable of emitting circularly polarized light have attracted growing attention for potential technological and biological applications. The efficiency of such devices depend on multiple parameters, in particular the m
Externí odkaz:
https://doaj.org/article/5635104678dc40119bb69b6f4c07b8b9
Publikováno v:
Molecules; Volume 28; Issue 12; Pages: 4702
Fluorinated organic compounds have superior physicochemical properties than general organic compounds due to the strong C-F single bond; they are widely used in medicine, biology, pesticides, and materials science. In order to gain a deeper understan
Akademický článek
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Autor:
V. A. Tolkachev
Publikováno v:
Journal of Applied Spectroscopy. 88:589-595
The average distance between combining electronic states, including those under magnetically induced circular luminescence, is shown to be determined from the diffuse electronic-vibrational (vibronic) absorption and emission spectra of the magnetical
Autor:
Slenczka, Alkwin, Toennies, Jan Peter
This open access book covers recent advances in experiments using the ultra-cold, very weakly perturbing superfluid environment provided by helium nanodroplets for high resolution spectroscopic, structural and dynamic studies of molecules and synthet
Externí odkaz:
https://library.oapen.org/handle/20.500.12657/56991
Publikováno v:
The Journal of Physical Chemistry Letters
Addi: Archivo Digital para la Docencia y la Investigación
Universidad del País Vasco
Addi. Archivo Digital para la Docencia y la Investigación
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Addi: Archivo Digital para la Docencia y la Investigación
Universidad del País Vasco
Addi. Archivo Digital para la Docencia y la Investigación
instname
We show how linear vibronic spectra in molecular systems can be simulated efficiently using first-principles approaches without relying on the explicit use of multiple Born-Oppenheimer potential energy surfaces. We demonstrate and analyze the perform
Akademický článek
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Autor:
V. A. Tolkachev
Publikováno v:
Journal of Applied Spectroscopy. 88:1040-1042