Controlling Photorelaxation in Uracil with Shaped Laser Pulses: A Theoretical Assessment

Daniel Keefer, Sebastian Thallmair, Spiridoula Matsika, Regina de Vivie-Riedle*

*Corresponding author for this work

Research output: Contribution to journalArticleAcademicpeer-review

36 Citations (Scopus)

Abstract

The RNA nucleobase uracil can suffer from photo damage when exposed to UV light, which may lead to severe biological defects. To prevent this from happening in most cases, uracil exhibits an ultrafast relaxation mechanism from the electronically excited state back to the ground state. In our theoretical work, we demonstrate how this process can be significantly influenced using shaped laser pulses. This not only sheds new light on how efficient nature is in preventing biologically momentous photo damage. We also show a way to entirely prevent photorelaxation by preparing a long-living wave packet in the excited state. This can enable new experiments dedicated to finding the photochemical pathways leading to uracil photodamage. The optimized laser pulses we present fulfill all requirements to be experimentally accessible.

Original languageEnglish
Pages (from-to)5061-5066
Number of pages6
JournalJournal of the American Chemical Society
Volume139
Issue number14
DOIs
Publication statusPublished - 12-Apr-2017
Externally publishedYes

Keywords

  • INITIO MOLECULAR-DYNAMICS
  • RESOLVED PHOTOELECTRON-SPECTROSCOPY
  • FIELD DISSOCIATIVE IONIZATION
  • EXCITED-STATE DYNAMICS
  • AB-INITIO
  • RELAXATION DYNAMICS
  • GAS-PHASE
  • CONICAL INTERSECTIONS
  • NONADIABATIC DYNAMICS
  • PROBE SPECTROSCOPY

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