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Record W4402773526 · doi:10.1021/acs.macromol.4c01675

Smart Polymer Solution and Thermal Conductivity: How Important Is an Exact Polymer Conformation?

2024· article· en· W4402773526 on OpenAlexafffund
M. M. Chowdhury, Robinson Cortes–Huerto, Debashish Mukherji

Bibliographic record

VenueMacromolecules · 2024
Typearticle
Languageen
FieldMaterials Science
TopicPolymer crystallization and properties
Canadian institutionsUniversity of British Columbia
FundersCanada First Research Excellence Fund
KeywordsPolymerThermal conductivityMaterials sciencePolymer chemistryPolymer scienceConductivityThermalChemical engineeringChemistryThermodynamicsComposite materialPhysical chemistryPhysicsEngineering

Abstract

fetched live from OpenAlex

Heat management in devices is the key to their efficiency and longevity. Here, thermal switches (TS) are of great importance because of their ability to transition between different thermal conductivity κ states. While traditional TS are bulky and slow, recent experiments have suggested “smart” responsive (bioinspired) polymers as their fast alternatives. One example is poly( N -isopropylacrylamide) (PNIPAM) in water, where κ drops suddenly around a temperature T l ≃ 305 K when PNIPAM undergoes a coil-to-globule transition. At first glance, this may suggest that the change in polymer conformation has a direct influence on TS. However, it may be presumptuous to trivially “only” link conformations with TS, especially because many complex microscopic details control macroscopic conformational transition. Motivated by this, we study TS in “smart” polymers using generic molecular dynamics simulations. As the test cases, we investigate two different modes of polymer collapse using external stimuli, i.e., changing T and cosolvent mole fraction x c . Collapse upon increasing T shows a direct correlation between the conformation and κ switching, while no correlation is observed in the latter case. These results suggest that the (co)solvent–monomer interactions play a greater important role than the exact conformation in dictating TS. While some results are compared with the available experiments, possible future directions are also highlighted.

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 categoriesInsufficient payload (model declined to judge)
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 score0.015
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0010.001
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 head0.023
GPT teacher head0.247
Teacher spread0.224 · 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.

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

Citations1
Published2024
Admission routes2
Has abstractyes

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