Evidence map›Paper›PMID 31183032›Full record

ArticleChemical science2019

The full dynamics of energy relaxation in large organic molecules: from photo-excitation to solvent heating.

Vytautas Balevičius, Tiejun Wei, Devis Di Tommaso, Darius Abramavicius, Jürgen Hauer, Tomas Polívka, Christopher D P Duffy

Abstract read
In one paragraph

Article in Chemical science, 2019. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 19 papers.

0numbers the graph read from it
0cells of the map it votes in
19citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

19 citing papers in PubMed.

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  7. Generalized Einstein relations between absorption and emission spectra at thermodynamic equilibrium.Proceedings of the National Academy of Sciences of the United States of America · 2024
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  10. Review
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  13. Review
  14. Modeling the heating and cooling of a chromophore after photoexcitation.Physical chemistry chemical physics : PCCP · 2022
    Article
  15. Article
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4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

7 authors.

Vytautas BalevičiusSchool of Chemical and Biological Sciences , Queen Mary University of London , Mile End Road , London E1 4NS , UK . Email: c.duffy@qmul.ac.uk.ORCID 0000-0002-7475-2112
Tiejun WeiSchool of Chemical and Biological Sciences , Queen Mary University of London , Mile End Road , London E1 4NS , UK . Email: c.duffy@qmul.ac.uk.
Devis Di TommasoSchool of Chemical and Biological Sciences , Queen Mary University of London , Mile End Road , London E1 4NS , UK . Email: c.duffy@qmul.ac.uk.ORCID 0000-0002-4485-4468
Darius AbramaviciusInstitute of Chemical Physics , Vilnius University , Sauletekio av. 9 , Vilnius , LT-10222 , Lithuania.ORCID 0000-0003-0087-9791
Jürgen HauerFakultät für Chemie , Technical University of Munich , Lichtenbergstraße 4 , D-85748 Garching , Germany.
Tomas PolívkaInstitute of Physics and Biophysics , Faculty of Science , University of South Bohemia , Branišovská 1760 , 37005 České Budějovice , Czech Republic.
Christopher D P DuffySchool of Chemical and Biological Sciences , Queen Mary University of London , Mile End Road , London E1 4NS , UK . Email: c.duffy@qmul.ac.uk.ORCID 0000-0001-6462-8495

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

In some molecular systems, such as nucleobases, polyenes or the active ingredients of sunscreens, substantial amounts of photo-excitation energy are dissipated on a sub-picosecond time scale, raising questions such as: where does this energy go or among which degrees of freedom it is being distributed at such early times? Here we use transient absorption spectroscopy to track excitation energy dispersing from the optically accessible vibronic subsystem into the remaining vibrational subsystem of the solute and solvent. Monitoring the flow of energy during vibrational redistribution enables quantification of local molecular heating. Subsequent heat dissipation away from the solute molecule is characterized by classical thermodynamics and molecular dynamics simulations. Hence, we present a holistic approach that tracks the internal temperature and vibronic distribution from the act of photo-excitation to the restoration of the global equilibrium. Within this framework internal vibrational redistribution and vibrational cooling are emergent phenomena. We demonstrate the validity of the framework by examining a highly controversial example, carotenoids. We show that correctly accounting for the local temperature unambiguously explains their energetically and temporally congested spectral dynamics without the

Identifiers

PMID31183032
PMCPMC6521204

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.