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Record W2945640850 · doi:10.1002/polb.24837

Classifying formulations of crosslinked polyethylene pipe by applying machine‐learning concepts to infrared spectra

2019· article· en· W2945640850 on OpenAlex
Melanie Hiles, Michael Grossutti, John Dutcher

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

VenueJournal of Polymer Science Part B Polymer Physics · 2019
Typearticle
Languageen
FieldChemistry
TopicSpectroscopy and Chemometric Analyses
Canadian institutionsUniversity of Guelph
FundersNatural Sciences and Engineering Research Council of CanadaCanada Research Chairs
KeywordsPrincipal component analysisCluster analysisPolyethyleneSupport vector machineChemometricsInfrared spectroscopyComputer sciencePattern recognition (psychology)Biological systemArtificial intelligenceMaterials scienceChemistryMachine learningComposite materialOrganic chemistry

Abstract

fetched live from OpenAlex

ABSTRACT Crosslinked polyethylene (PEX‐a) pipes are emerging as promising replacements for traditional metal or concrete pipes used for water, gas, and sewage transport. Understanding the relationship between pipe formulation and performance is critical to their proper design and implementation. We have developed a methodology using principal component analysis (PCA) and the machine learning techniques of k ‐means clustering and support vector machines (SVM) to compare and classify different PEX‐a pipe formulations based on characteristic infrared (IR) spectroscopy absorbance peaks. The application of PCA revealed that a large percentage (89%) of the total variance could be explained by the first three principal components (PC1‐PC3), with distinct clustering of the data for each formulation. By examining the contribution of the individual IR bands to the PCs, we determined that PC1 could be attributed to different peroxide crosslinkers, whereas PC2 and PC3 could be attributed to differences in the additives. Using the PCA results as input to k ‐means clustering and SVM resulted in very high accuracy of classifying the different pipe formulations. Our approach highlights the advantages of using PCA and machine learning techniques to characterize different formulations of PEX‐a pipes, which is important to achieve a detailed understanding of the pipe formulation and manufacturing process. © 2019 Wiley Periodicals, Inc. J. Polym. Sci., Part B: Polym. Phys. 2019 , 57 , 1255–1262

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 categoriesMeta-epidemiology (narrow)
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 score0.018
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0000.002
Science and technology studies0.0000.000
Scholarly communication0.0000.001
Open science0.0010.000
Research integrity0.0000.001
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 head0.018
GPT teacher head0.307
Teacher spread0.289 · 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