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Record W4206639548 · doi:10.14447/jnmes.v24i2.a02

Conceptualized Simulation for Templating Carbon Based Nano Structures for Li-ion Batteries: A DFT Investigation

2021· article· en· W4206639548 on OpenAlexvenueno aff
Syed Zohaib Javaid Zaidi, Sammer-ul Hassan, Muhammad Arslan Raza, Christian Harito, Brian Yuliarto, Frank C. Walsh

Bibliographic record

VenueJournal of New Materials for Electrochemical Systems · 2021
Typearticle
Languageen
FieldMaterials Science
TopicGraphene research and applications
Canadian institutionsnot available
Fundersnot available
KeywordsAnodeGrapheneLithium (medication)Materials scienceCarbon nanotubeIonCarbon fibersNanotechnologyChemical engineeringComposite numberChemistryElectrodePhysical chemistryComposite materialOrganic chemistry

Abstract

fetched live from OpenAlex

CNT (10, 0) is carbon nanotube; Graphene is a 2-dimensional carbon allotrope being light weight and Chitosan is a linear polysaccharide. In this work, detailed analysis of the above three stated compounds as anode for lithium-ion batteries is stated. The density function theory (DFT) computations were used to carry out the investigation of the above stated compound as anode materials for the lithium-ion batteries. The analysis shows that Graphene and Chitosan are highly favorable to be used as anodes materials for the lithium-ion batteries. The results show that the Vcell of Graphene and Chitosan when they are used as an anode for lithium-ion batteries are extremely higher as compared to CNT (10, 0) at 5.632 Volts, 4.719 Volts and 1.22 Volts, respectively.

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: Empirical
Teacher disagreement score0.010
Threshold uncertainty score0.035

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.001
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0010.001
Science and technology studies0.0010.001
Scholarly communication0.0010.001
Open science0.0010.001
Research integrity0.0010.001
Insufficient payload (model declined to judge)0.0100.001

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 head0.042
GPT teacher head0.323
Teacher spread0.281 · 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

Citations5
Published2021
Admission routes1
Has abstractyes

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