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Record W4316466939 · doi:10.3390/inorganics11010043

Heterogenous Preparations of Solution-Processable Cobalt Phthalocyanines for Carbon Dioxide Reduction Electrocatalysis

2023· article· en· W4316466939 on OpenAlexaff
Elahe Tajbakhsh, Declan McKearney, Daniel B. Leznoff, Jeffrey J. Warren

Bibliographic record

VenueInorganics · 2023
Typearticle
Languageen
FieldEnergy
TopicCO2 Reduction Techniques and Catalysts
Canadian institutionsSimon Fraser University
Fundersnot available
KeywordsCobaltElectrocatalystCatalysisPhthalocyanineChemistryAlkoxy groupAlkylCombinatorial chemistryInorganic chemistryOrganic chemistryElectrodeElectrochemistryPhysical chemistry

Abstract

fetched live from OpenAlex

The development and implementation of technology that can capture and transform carbon dioxide (CO2) is of ongoing interest. To that end, the integration of molecular electrocatalysts into devices is appealing because of the desirable features of molecules, such as the ability to modify active sites. Here, we explore how the identity of the aliphatic group in 1,4,8,11,15,18,22,25-octaalkoxyphthalocyanine cobalt(II) affects the catalytic behavior for heterogeneous CO2 reduction electrocatalysis. The alkyl R-groups correspond to n-butoxy, sec-butoxy, and 2-ethylhexoxy. All of the catalysts are soluble in organic solvents and are readily solution-processed. However, the larger 2-ethylhexoxy group showed solution aggregation behavior at concentrations ≥1 mM, and it was, in general, an inferior catalyst. The other two catalysts show comparable maximum currents, but the octa sec-butoxy-bearing catalyst showed larger CO2 reduction rate constants based on foot-of-the-wave analyses. This behavior is hypothesized to be due to the ability of the sec-butoxy groups to eliminate the ability of the alkoxy oxygen to block Co Sites via ligation. CO2 reduction activity is rationalized based on solid-state structures. Cobalt(II) phthalocyanine and its derivatives are known to be good CO2 reduction catalysts, but the results from this work suggest that straightforward incorporation of bulky groups can improve the processability and per site activity by discouraging aggregation.

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 score0.003

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 head0.018
GPT teacher head0.269
Teacher spread0.251 · 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

Citations9
Published2023
Admission routes1
Has abstractyes

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