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Record W2093987473 · doi:10.1063/1.2780171

Direct correlation function for the square-well potential

2007· article· en· W2093987473 on OpenAlexaff
Yiping Tang

Bibliographic record

VenueThe Journal of Chemical Physics · 2007
Typearticle
Languageen
FieldEngineering
TopicPhase Equilibria and Thermodynamics
Canadian institutionsHoneywell (Canada)
Fundersnot available
KeywordsPiecewiseSquare (algebra)Finite potential wellFunction (biology)Correlation function (quantum field theory)PolynomialExtension (predicate logic)Radial distribution functionOrder (exchange)Work (physics)Expression (computer science)MathematicsApplied mathematicsStatistical physicsMathematical analysisPhysicsChemistryComputational chemistryQuantum mechanicsComputer scienceGeometry

Abstract

fetched live from OpenAlex

An analytical expression of direct correlation function (DCF) for the square-well potential is developed. The development is based on the first-order mean spherical approximation and its extension to the functionality of the existing radial distribution function. The developed DCF is a combination of a special polynomial function introduced in this work. The combination is piecewise in four regions [0, lambda - 1], [lambda - 1,2 - lambda], [2 - lambda,1], and [1,lambda] for lambda < 1.5 or [0,2 - lambda], [2 - lambda, lambda - 1], [lambda - 1, 1], and [1, lambda] for lambda > 1.5. In addition, the DCF is continuous to second-order inside hard core and discontinuous at r=1 and r=lambda outside it. The behavior of DCF is analyzed by some detail calculations.

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)0.001
metaresearch head score (Gemma)0.002
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Theoretical or conceptual · Consensus signal: Theoretical or conceptual
GenreCandidate signal: Empirical · Consensus signal: none
Teacher disagreement score0.004
Threshold uncertainty score0.014

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0010.002
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.001
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)0.0040.001

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 head0.007
GPT teacher head0.208
Teacher spread0.201 · 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 designTheoretical or conceptual
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

Citations27
Published2007
Admission routes1
Has abstractyes

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