Ab Initio Quantum Dynamical Study on Ultrafast Nonradiative Transition Pathways of Pyrazine

Manabu Kanno, Ito Yuta, Noriyuki Shimakura, Shiro Koseki, Hirohiko Kono, Yuichi Fujimura

Research output: Chapter in Book/Report/Conference proceedingConference contributionpeer-review

Abstract

We theoretically verified the participation of optically dark n pi* states other than S-1 in ultrafast internal conversion of pyrazine. Contrary to a recent semiclassical study, our quantum dynamical calculations demonstrated that their contributions are negligible.
Original languageEnglish
Title of host publication19th International Conference on Ultrafast Phenomena
PublisherSpringer-Verlag Berlin Heidelberg
Pages176-179
Number of pages4
Volume162
DOIs
StatePublished - 2015

Keywords

  • CONICAL INTERSECTION

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