Excited state evolution of DNA stacked adenines resolved at the CASPT2//CASSCF/Amber level: from the bright to the excimer state and back

Author:

Conti Irene123,Nenov Artur123,Höfinger Siegfried45678,Flavio Altavilla Salvatore123,Rivalta Ivan910111213,Dumont Elise141516,Orlandi Giorgio123,Garavelli Marco1231415

Affiliation:

1. Dipartimento di Chimica “G. Ciamician”

2. Università di Bologna

3. Bologna, Italy

4. Zentraler Informatikdienst

5. Technische Universität Wien

6. 1040 Wien, Austria

7. Department of Physics

8. Michigan Technological University

9. Université de Lyon

10. CNRS

11. Institut de Chimie de Lyon

12. École Normale Supérieure de Lyon

13. F-69364 Lyon Cedex 07, France

14. Laboratoire de Chimie

15. Ecole Normale Supérieure de Lyon

16. Lyon, France

Abstract

La and excimer state population exchange, along the common puckering decay coordinate, explains the longest DNA lifetime component.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

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