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Record W3031763060 · doi:10.1021/acsami.0c07039

Highly Selective Aromatization of Octane over Pt–Zn/UZSM-5: The Effect of Pt–Zn Interaction and Pt Position

2020· article· en· W3031763060 on OpenAlexafffund
Peng He, Yunlei Chen, Jack Jarvis, Shijun Meng, Lijia Liu, Xiaodong Wen, Hua Song

Bibliographic record

VenueACS Applied Materials & Interfaces · 2020
Typearticle
Languageen
FieldChemistry
TopicZeolite Catalysis and Synthesis
Canadian institutionsUniversity of Calgary
FundersMitacs
KeywordsMaterials scienceAromatizationOctanePosition (finance)ZincSelectivityInorganic chemistryCatalysisOrganic chemistryMetallurgyChemistryBusiness

Abstract

fetched live from OpenAlex

The effects of Zn–Pt interaction and Pt dispersion over a uniform compact cylindrical shape ZSM-5 (UZSM-5) on the catalytic octane aromatization performance are investigated. The comparison between different Pt- and Zn-modified ZSM-5 catalysts demonstrates the significance of ZSM-5 morphology and, more importantly, the metal distributions on it. For the UZSM-5 support, Pt atoms prefer to occupy the sites within its inner pores, resulting in high selectivity to xylenes during the octane aromatization. The Zn deposit in inner pores and higher dispersion of Pt lead to the spillover of Pt sites to the external surface, which is critical for the activation of octane to produce reaction intermediates that are further converted to aromatics over the inner pore catalytic sites. These effects are evidenced by a diffuse reflection infrared Fourier transform spectroscopy study of CO adsorbed on the catalyst surface. In situ X-ray absorption fine structure spectra are collected to probe the coordination number and the chemical environment of Pt and Zn atoms in the catalysts during the octane aromatization reaction. Pt and Zn are well dispersed and stable during the reaction, and a partial reduction of Pt during the reaction is observed. A theoretical study using the density functional theory method predicts that the reaction and transition-state intermediates upon octane activation are better stabilized by Pt(111) of Pt external surface sites with a smaller activation barrier, indicating their significance in C–H activation. This hypothesis is further evidenced by comparing the octane aromatization performance of various modified catalysts through varying Zn loading, blocking inner pores, and covering the external catalytic sites with SiO2.

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 score0.003
Threshold uncertainty score0.654

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.000
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 head0.006
GPT teacher head0.223
Teacher spread0.216 · 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

Citations39
Published2020
Admission routes2
Has abstractyes

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