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Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method
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Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method

Published on: July 19, 2019

Ab initio molecular dynamics of excited-state intramolecular proton transfer around a three-state conical

Joshua D Coe1, Todd J Martínez

  • 1Department of Chemistry, Beckman Institute, and Frederick Seitz Materials Research Laboratory, University of Illinois at Urbana-Champaign, 600 South Mathews Avenue, Urbana, Illinois 61801.

The Journal of Physical Chemistry. A
|January 13, 2006
PubMed

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