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Record W2625413977 · doi:10.1021/acs.jpcc.7b04197

Interfacial Electron Transfer Followed by Photooxidation in <i>N</i>,<i>N</i>-Bis(<i>p</i>-anisole)aminopyridine–Aluminum(III) Porphyrin–Titanium(IV) Oxide Self-Assembled Photoanodes

2017· article· en· W2625413977 on OpenAlexafffund
Gary N. Lim, Svante Hedström, Kenneth A. Jung, Pierce A. D. Smith, Víctor S. Batista, Francis D’Souza, Art van der Est, Prashanth K. Poddutoori

Bibliographic record

VenueThe Journal of Physical Chemistry C · 2017
Typearticle
Languageen
FieldMaterials Science
TopicPorphyrin and Phthalocyanine Chemistry
Canadian institutionsBrock UniversityUniversity of Prince Edward Island
FundersNatural Sciences and Engineering Research Council of CanadaOffice of Science
KeywordsPorphyrinChemistryElectron transferPhotochemistryAnisoleCovalent bondElectron acceptorCatalysisOrganic chemistry

Abstract

fetched live from OpenAlex

Two self-assembled photoanodes have been constructed by exploiting the unique optical and structural properties of aluminum(III) porphyrin (AlPor) in conjunction with TiO 2 nanoparticles as an electron acceptor and bis( p -anisole)aminopyridine (BAA–Py) as an electron donor. AlPor is bound to the TiO 2 surface by either: (i) a benzohydroxamic acid bridge, in which the hydroxamic acid acts as an anchor or (ii) direct covalent binding of Al via an ether bond. The open sixth coordination site of the Al center is then used to coordinate BAA–Py through Lewis acid–base interactions, which results in donor–photosensitizer–semiconductor constructs that can be used as photoanodes. The two photoanodes were characterized by steady-state and transient spectroscopic techniques as well as computational methods. Transient-absorption studies show that in the absence of BAA–Py both the photoanodes exhibit electron injection from AlPor to the conduction band of TiO 2 . However, the injection efficiencies and kinetics are strongly dependent on the linker with faster and more efficient injection occurring when the porphyrin is directly bound. Kinetic results also suggest that the recombination is faster in directly bound AlPor than benzohydroxamic acid bridged AlPor. When BAA–Py is coordinated to AlPor, electron injection from AlPor to TiO 2 is followed by electron transfer from BAA–Py to the oxidized AlPor. The injection efficiencies modeled using density functional theory and semiempirical tight-binding calculations are consistent with experimentally observed trends.

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 head0.008
GPT teacher head0.246
Teacher spread0.238 · 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

Citations17
Published2017
Admission routes2
Has abstractyes

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