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Record W4397030606 · doi:10.1021/acscatal.4c00742

Phosphorization-Induced “Fence Effect” on the Active Hydrogen Species Migration Enables Tunable CO<sub>2</sub> Hydrogenation Selectivity

2024· article· en· W4397030606 on OpenAlexaff
Chunpeng Wu, Jiahui Shen, Xingda An, Zhiyi Wu, Shuairen Qian, Shumin Zhang, Zhiqiang Wang, Bin Song, Yi Cheng, Binhang Yan, Tsun‐Kong Sham, Xiaohong Zhang, Chaoran Li, Kai Feng, Le He

Bibliographic record

VenueACS Catalysis · 2024
Typearticle
Languageen
FieldChemical Engineering
TopicCatalysts for Methane Reforming
Canadian institutionsWestern University
FundersNational Postdoctoral Program for Innovative TalentsHigher Education Discipline Innovation ProjectCollaborative Innovation Center of Suzhou Nano Science and TechnologySoochow UniversityChina Postdoctoral Science FoundationNational Natural Science Foundation of China
KeywordsCatalysisSelectivityMethanationChemistryFence (mathematics)HydrogenAdsorptionChemical engineeringPhotochemistryCombinatorial chemistryOrganic chemistry

Abstract

fetched live from OpenAlex

Incorporating phosphorus (P) into the active metals of a catalyst is an effective strategy to enhance the catalytic performance. However, the mechanisms underlying the influence of the introduced phosphorus species on catalytic performance remain largely unknown. Herein, we observe a pronounced shift in the product selectivity of the CO 2 hydrogenation from CH 4 to CO upon introducing P into the Ru/SiO 2 catalysts. This alteration in product selectivity is attributed to the role of introduced P as a “fence” hindering the migration of active H species. The adsorbed CO, a key intermediate species for CO 2 methanation, is preferentially desorbed before H species cross the “fence” for further hydrogenation, thereby weakening the H 2 -assisted CO activation process and consequently inhibiting CH 4 generation. Our findings provide in-depth insights into the origin of phosphorization-induced modulation of product selectivity in CO 2 hydrogenation. Furthermore, the concept of phosphorization-induced “fence effect” opens a promising avenue for catalyst design in various industrial hydrogenation processes.

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 score0.002
Threshold uncertainty score0.006

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 studies0.0000.001
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0020.000

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 head0.010
GPT teacher head0.225
Teacher spread0.214 · 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

Citations21
Published2024
Admission routes1
Has abstractyes

Explore more

Same venueACS CatalysisSame topicCatalysts for Methane ReformingFrench-language works237,207