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Record W4309958318 · doi:10.1016/j.xcrp.2022.101172

Olefin cyclization on Cu(111) driven by subsurface carbon and ultraviolet irradiation

2022· article· en· W4309958318 on OpenAlex

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.
fundA Canadian funder is recorded on the work.

Bibliographic record

VenueCell Reports Physical Science · 2022
Typearticle
Languageen
FieldEngineering
TopicSurface Chemistry and Catalysis
Canadian institutionsInstitut National de la Recherche Scientifique
FundersHarbin Institute of TechnologyState Key Laboratory of Urban Water Resource and EnvironmentNational Natural Science Foundation of ChinaCanada Research Chairs
KeywordsOlefin fiberSelectivityCatalysisIrradiationYield (engineering)PhotochemistryUltravioletUltraviolet irradiationChemistrySubstrate (aquarium)Carbon fibersReaction rateCombinatorial chemistryMaterials scienceOrganic chemistryOptoelectronics

Abstract

fetched live from OpenAlex

Among several major unresolved challenges in reaction chemistry, controlling the yield and selectivity is particularly crucial. For on-surface synthesis (OSS), a prototype for basic understanding of reaction mechanisms, such control remains elusive. Here, using olefin cyclization, an important reaction in organic synthesis yet unknown for OSS to the best of our knowledge, as the model system, we propose a strategy to address this challenge by introducing carbon into the subsurface of Cu(111) (C-Cuδ+) and UV irradiation. The total olefin coupling rate on C-Cuδ+ increases to 10.1- and 5.3-fold higher than that on pristine Cu(111) at 298 and 323 K, respectively. The initial cyclization temperature reduces by 55 K on C-Cuδ+. UV irradiation further promotes the cyclization ratio from 22% to 40.3%. By integrating surface catalysis of the substrate with photochemistry of light-absorbing reactants, our results may open up a promising route for overcoming high reaction barriers and regulating selectivity in OSS.

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.

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 score0.021
Threshold uncertainty score0.435

Codex and Gemma teacher scores by category

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)0.0000.000

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 head0.003
GPT teacher head0.186
Teacher spread0.182 · 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