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Record W1973509201 · doi:10.1139/v99-217

A kinetic modeling study of ethylene pyrolysis

2000· article· en· W1973509201 on OpenAlexvenueno aff
John M. Roscoe, Alain R. Bossard, M. H. Back

Bibliographic record

VenueCanadian Journal of Chemistry · 2000
Typearticle
Languageen
FieldChemical Engineering
TopicAdvanced Combustion Engine Technologies
Canadian institutionsnot available
FundersU.S. Department of Energy
KeywordsChemistryDisproportionationRadicalEthyleneYield (engineering)DecompositionReaction rate constantKinetic energyThermal decompositionAtmospheric temperature rangePyrolysisPhysical chemistryMedicinal chemistryKineticsOrganic chemistryThermodynamicsCatalysis

Abstract

fetched live from OpenAlex

A kinetic model is presented for the pyrolysis of ethylene at pressures ranging from 0.8 to 27 kPa and temperatures from 774 to 1023 K. The model is based on experimental measurements of C2H2, C2H6, C3H6, 1-C4H8, and 1,3-C4H6. In this temperature range the reaction is initiated by the disproportionation of C2H4 and the observed products result from reactions of the C2H3 and C2H5 radicals produced in this process. The C2H2 and 1,3-C4H6 result from reactions of C2H3 while C2H6, C3H6, and 1-C4H8 result from reactions of C2H5. C2H2 is produced exclusively by the decomposition of the C2H3 radical. This process is in its falloff region throughout the range of experimental conditions examined and the yield of C2H2 provides a measure of the degree of falloff. The production of 1,3-C4H6 is controlled by the reaction C4H7 –> C4H6 + H. The rate constants for this reaction were independent of pressure and are given as a function of temperature by k = 2.2 × 1013 exp (-19.6 × 103/T). Production of C2H6 is controlled by the reaction C2H5 + C2H4 –> C2H6 + C2H3. The rate constant for this reaction is given as a function of temperature by k = 5.83 × 1011 exp (-14.6 × 103/T). C3H6 is produced by decomposition of 2-C4H9 and is controlled kinetically by the isomerization reaction 1-C4H9 –> 2-C4H9. The temperature dependence of the rate constants obtained for this reaction leads to a preexponential factor of approximately 3 × 1016 and an activation energy of approximately 200 kJ mol-1. The yield of 1-C4H8 is controlled by 1-C4H9 –> 1-C4H8 + H. The rate constants for this reaction were independent of pressure and are given as a function of temperature by k = 2.97 × 1012 exp (-17.1 × 103/T). Key words: kinetic modeling, ethylene pyrolysis.

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)0.001
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Simulation or modeling · Consensus signal: Simulation or modeling
GenreCandidate signal: Empirical · Consensus signal: none
Teacher disagreement score0.010
Threshold uncertainty score0.019

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.001
Meta-epidemiology (narrow)0.0010.000
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0010.001
Science and technology studies0.0010.000
Scholarly communication0.0010.001
Open science0.0010.000
Research integrity0.0010.001
Insufficient payload (model declined to judge)0.0020.001

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 head0.011
GPT teacher head0.213
Teacher spread0.202 · 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 designSimulation or modeling
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

Citations16
Published2000
Admission routes1
Has abstractyes

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