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Record W2335250551 · doi:10.1021/ef1009692

Comparative High Temperature Shock Tube Ignition of C1−C4 Primary Alcohols

2010· article· en· W2335250551 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

VenueEnergy & Fuels · 2010
Typearticle
Languageen
FieldEngineering
TopicCombustion and Detonation Processes
Canadian institutionsMcGill University
FundersNatural Sciences and Engineering Research Council of CanadaFonds Québécois de la Recherche sur la Nature et les Technologies
KeywordsShock tubeChemistryMethanolIgnition systemStoichiometryThermodynamicsOxygenAnalytical Chemistry (journal)n-ButanolDilutionEthanolPhysical chemistryShock waveButanolOrganic chemistryPhysics

Abstract

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The high temperature ignition of C1−C4 primary alcohols, methanol, ethanol, n -propanol, and n -butanol, is studied behind reflected shock waves. The experiments are carried out at pressures of 2, 10, and 12 atm with argon/oxygen ratios of 10, 15, and 20 under lean, ϕ = 0.5, stoichiometric, ϕ = 1, and rich, ϕ = 2, conditions between 1070 and 1760 K. It is observed that the ignition delay time data for ethanol, n -propanol, and n -butanol collapse under conditions of constant equivalence ratio, pressure, and dilution. The ignition delay times of methanol are comparable with the other alcohols but show a slightly lower activation energy than the other fuels. The observed collapse of the ignition delay times for the four alcohols under lean-to-stoichiometric conditions is comparable with recent observations by Veloo et al. (Veloo, P. S.; Wang, Y. L.; Egolfopoulos, F. N.; Westbrook, C. K. Combust. Flame 2010, 157, 1989−2004) that over a range of equivalence ratios less than one, methanol, ethanol, and n -butanol have similar laminar flame speeds. Measured ignition delay times for selected conditions are compared to simulated delay times using their corresponding chemical kinetic models developed in previous studies: methanol by Li et al. (Li, J.; Zhao, Z.; Kazakov, A.; Chaos, M.; Dryer, F.; Scire, J. Int. J. Chem. Kinet. 2007, 39, 109−136), ethanol by Marinov (Marinov, N. Int. J. Chem. Kinet. 1999, 31, 183−220), n -propanol by Johnson et al. (Johnson, M. V.; Goldsborough, S. S.; Serinyel, Z.; O’Toole, P.; Larkin, E.; Malley, G.; Curran, H. J. Energy Fuels 2009, 23, 5886−5898), and n -butanol by Sarathy et al. (Sarathy, S. M.; Thomson, M. J.; Togbé, C.; Dagaut, P.; Halter, F.; Mounaim-Rousselle, C. Combust. Flame 2009, 156, 852−864). The agreement of the various mechanisms with experiment is reasonable; however, the lower temperature ignition delay times for n -propanol and n -butanol tend to be longer than measured. The closest agreement between experiment and model predictions is observed for ethanol with the Marinov mechanism. Ignition delay time correlations for the alcohols are obtained by linear regression of the experimental data. This correlation method is also applied to the chemical kinetic mechanisms to obtain simplified expressions for their ignition delay times that allow a general assessment of their performance relative to experiment. Although sensitivity and reaction pathway analyses indicate similar modeling approaches for the four alcohols, the models do not capture the quantitative similarity observed in the experiment. These results will be useful in the process of developing a generalized chemical kinetic model for C1−C4 primary alcohol combustion as well as reduced models for combustion engineering.

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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 score0.030
Threshold uncertainty score0.598

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)0.0010.000

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 head0.009
GPT teacher head0.219
Teacher spread0.210 · 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