Simulation of UV absorption spectra and relaxation dynamics of uracil and uracil

Simulation of UV absorption spectra and relaxation dynamics of uracil and uracil–water clusters

Published:2021 Issue:4 Volume:23 Page:2594-2604
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Milovanović Branislav¹²³⁴^ORCID,Novak Jurica⁵⁶⁷⁸⁹^ORCID,Etinski Mihajlo¹²³⁴^ORCID,Domcke Wolfgang¹⁰¹¹¹²¹³^ORCID,Došlić Nađa⁵⁶⁷⁸^ORCID

Affiliation:

1. University of Belgrade

2. Faculty of Physical Chemistry

3. Belgrade

4. Serbia

5. Department of Physical Chemistry

6. Ruđer Bošković Institute

7. Zagreb

8. Croatia

9. Higher Medical and Biological School

10. Department of Chemistry

11. Technical University of Munich

12. Garching

13. Germany

Abstract

UV Spectroscopy and relaxation dynamics of uracil in the gas phase and in aqueous solution resolved using ADC(2) based trajectory-surface-hopping calculations.

Funder

European Cooperation in Science and Technology

Alexander von Humboldt-Stiftung

Hrvatska Zaklada za Znanost

Ministry of Science and Higher Education of the Russian Federation

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2021/CP/D0CP05618A

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