MétaCan
Menu
Back to cohort
Record W4414821966 · doi:10.1021/jacs.5c12445

Controlling Selectivity in Electrochemical Conversion of Organic Mixtures through Dynamic Control of Electrode Microenvironments

2025· article· en· W4414821966 on OpenAlexfundno aff
Ricardo Mathison, Elina Rani, A. Leema Rose, Fjona Prendi, Casey Bloomquist, Miguel A. Modestino

Bibliographic record

VenueJournal of the American Chemical Society · 2025
Typearticle
Languageen
FieldChemistry
TopicElectrochemical Analysis and Applications
Canadian institutionsnot available
FundersDivision of Chemical, Bioengineering, Environmental, and Transport SystemsYork UniversityNational Science Foundation
KeywordsSelectivityElectrosynthesisElectrolysisSubstrate (aquarium)ElectrochemistryChemical reactionChemical kineticsAcrylonitrile

Abstract

fetched live from OpenAlex

Organic electrosynthesis using renewable electricity offers a sustainable approach to chemical manufacturing. Among its promising applications, the selective transformation of complex organic mixtures presents a valuable opportunity to eliminate costly separation processes and directly convert heterogeneous feedstocks to valuable products. However, controlling selectivity in reaction mixtures remains challenging due to competing reaction pathways and varying reactivities among substrates. Here, we demonstrate how selectivity in mixed organic electrosynthesis can be systematically controlled through a balance of reaction kinetics and mass transport limitations. Using acrylonitrile and crotononitrile mixtures as a model substrate mixture, we established quantitative relationships between substrate compositions, current densities, and product distributions that reveal distinct kinetically limited and mass transport-limited reaction regimes that control selectivity. We further demonstrated how pulsed electrolysis can be used to strategically control these reaction regimes to drive selectivity toward specific products. These insights create opportunities for developing adaptive and dynamic chemical manufacturing processes capable of handling complex feedstocks.

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 distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation 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 score0.008
Threshold uncertainty score0.578

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0000.001
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0010.000
Research integrity0.0000.001
Insufficient payload (model declined to judge)0.0000.000

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 head0.002
GPT teacher head0.221
Teacher spread0.219 · 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 teacher head, 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

Citations11
Published2025
Admission routes1
Has abstractyes

Explore more

Same venueJournal of the American Chemical SocietySame topicElectrochemical Analysis and ApplicationsFrench-language works237,207