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Record W4400026440 · doi:10.1016/j.molliq.2024.125378

Synthesis and investigation of acrylamide and 2-acrylamido-2-methylpropanesulfonic acid copolymer-modified graphene oxide nanomaterials with intensive viscosification capacity: An experimental and molecular dynamics study

2024· article· en· W4400026440 on OpenAlexaff
Han Jia, Haidong Jia, Qiuxia Wang, Xin Wei, Hui Yan, Yuanbo Wang, Qiang Wang, Kaihe Lv, Pan Huang

Bibliographic record

VenueJournal of Molecular Liquids · 2024
Typearticle
Languageen
FieldEngineering
TopicGraphene and Nanomaterials Applications
Canadian institutionsUniversity of Alberta
FundersNatural Science Foundation of Shandong ProvinceChina Scholarship CouncilNational Natural Science Foundation of China
KeywordsGrapheneCopolymerNanomaterialsAcrylamideOxideMaterials scienceMolecular dynamicsChemical engineeringNanotechnologyPolymerChemistryComputational chemistryComposite materialEngineering

Abstract

fetched live from OpenAlex

The polymer-modified nanomaterials with spontaneously generated cross-linked network greatly improve the dispersion viscosity, which is crucial for extending the sweep range and enhancing oil recovery. Recently, graphene oxide (GO) nanosheets have attracted extensive attention due to their high chemical reactivity and specific surface. In this paper, the AA molecule, synthesized by acrylamide (AM) and 2-acrylamido-2-methypropanesulfonic acid (AMPS) copolymerization, modified GO nanosheets (GAA) material is firstly synthesized and characterized. With the same content of AMPS segments, GAAn systems consistently exhibit better dispersion stability than AAn systems, along with higher absolute zeta potential values. The comprehensive investigation on the rheological property of GAA system reveals that GAA15 with the highest AMPS content exhibits the largest zero-shear viscosity (409.27 mPa·s) and the longest relaxation time. Based on the molecular dynamic simulation approaches, the aggregation morphology and stability of AA and GAA molecules are evaluated via the configuration analysis and the statistics of hydrogen bond numbers. The abundant binding sites from GO segments of GAA promote additional hydrogen bonds between GAA molecules and water, resulting in a more stable configuration. Molecular surface potential analysis and the independent gradient model based on Hirshfeld partition (IGMH) methods are further used to visualize the non-bonded interaction existed in cross-linked networks, which also predict and validate non-bonding interaction sites among molecular segments. The simulation results indicate higher viscosity in the GAA system should be ascribed to the formation of dispersion-strengthened cross-linked structures (AM-GO plane and GO-GO stacking segments). In summary, the microscopic viscosity-increasing mechanism of novel GAA system is proposed from the perspective of intermolecular interactions, which lays a preliminary theoretical foundation for the application of GAA material in the oil industry.

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 score0.007
Threshold uncertainty score0.844

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)0.0000.000

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 head0.010
GPT teacher head0.228
Teacher spread0.218 · 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

Citations7
Published2024
Admission routes1
Has abstractyes

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