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Royal Society of Chemistry, Physical Chemistry Chemical Physics, 2(22), p. 748-757, 2020

DOI: 10.1039/c9cp06086c

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On the interplay of solvent and conformational effects in simulated excited-state dynamics of a copper phenanthroline photosensitizer

Journal article published in 2020 by Gianluca Levi ORCID, Elisa Biasin ORCID, Asmus O. Dohn ORCID, Hannes Jónsson ORCID
This paper was not found in any repository, but could be made available legally by the author.
This paper was not found in any repository, but could be made available legally by the author.

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Abstract

QM/MM direct dynamics simulations in acetonitrile reveal the interplay between solvent and conformational effects in the photoinduced ultrafast flattening of a copper photosensitizer.