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Record W2054994889 · doi:10.1021/jp0465175

Sequential Forward S<sub>2</sub>−S<sub>2</sub> and Back S<sub>1</sub>−S<sub>1</sub> (Cyclic) Energy Transfer in a Novel Azulene−Zinc Porphyrin Dyad

2004· article· en· W2054994889 on OpenAlexaff
Marcin Ziółek, Jerzy Karolczak, Sergey V. Shevyakov, Alfred E. Asato, Andrzej Maciejewski, Ronald P. Steer

Bibliographic record

VenueThe Journal of Physical Chemistry A · 2004
Typearticle
Languageen
FieldMaterials Science
TopicPorphyrin and Phthalocyanine Chemistry
Canadian institutionsUniversity of Saskatchewan
Fundersnot available
KeywordsAzuleneChemistryMoietyConical intersectionPhotochemistryChromophoreExcited statePorphyrinInternal conversionStereochemistryMoleculeOrganic chemistryAtomic physics

Abstract

fetched live from OpenAlex

A covalently tethered dyad containing the azulene (Az) and zinc tetraphenylporphyrin (ZnP) chromophores has been synthesized and its excited-state dynamics investigated, using the tether-substituted monochromophoric species as reference compounds. One photon excitation of the dyad at 270 nm results in selective population of the S 2 state of the azulene moiety, followed by near-quantitative electronic relaxation in the cycle S 2 (Az)−S 2 (ZnP)−S 1 (ZnP)−S 1 (Az)−S 0 . Energy transfer from the S 2 state of the azulene moiety to the S 2 state of the ZnP moiety is ultrafast ( k eet > 2 × 10 12 s -1 ) and quantitative. The ZnP(S 2 ) moiety subsequently undergoes rapid ( k ic = 3 × 10 11 s -1 ), quantitative internal conversion to its S 1 state. Thereafter, the excitation residing on the S 1 state of the ZnP is returned to the Az moiety via an efficient (ca. 90%) back S 1 −S 1 energy transfer process ( k eet = 2.8 × 10 9 s -1 ). Ultimately the system returns to the electronic ground state via conical intersection of the azulene S 1 and S 0 surfaces in ca. 1 ps. The cyclic interchromophoric energy transfer rates are nearly the same in both acetonitrile and cyclohexane, suggesting that the conformation of the tether is similar in both solvents. Förster theory is inadequate in explaining the efficient energy transfer dynamics, and other processes such as the Dexter mechanism must be invoked.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.001
Threshold uncertainty score0.002

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0010.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.012
GPT teacher head0.224
Teacher spread0.212 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations31
Published2004
Admission routes1
Has abstractyes

Explore more

Same venueThe Journal of Physical Chemistry ASame topicPorphyrin and Phthalocyanine ChemistryFrench-language works237,207