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Record W1983699592 · doi:10.1103/physrevb.79.224305

Assessing the applicability of quantum corrections to classical thermal conductivity predictions

2009· article· en· W1983699592 on OpenAlexaff
Joseph E. Turney, Alan J. H. McGaughey, Cristina H. Amon

Bibliographic record

VenuePhysical Review B · 2009
Typearticle
Languageen
FieldMaterials Science
TopicThermal properties of materials
Canadian institutionsUniversity of Toronto
FundersCarnegie Mellon UniversityAdvanced Micro Devices
KeywordsPhysicsPhononQuantumThermal conductivityThermalZero-point energyCondensed matter physicsQuantum dynamicsQuantum mechanicsStatistical physicsThermodynamics

Abstract

fetched live from OpenAlex

The validity of the commonly used quantum corrections for mapping a classically predicted thermal conductivity onto a corresponding quantum value are assessed by self-consistently predicting the classical and quantum thermal conductivities of a crystalline silicon system via lattice-dynamics calculations. Applying the quantum corrections to the classical predictions, with or without the zero-point energy, does not bring them into better agreement with the quantum predictions compared to the uncorrected classical values above temperatures of 200 K. By examining the mode dependence of the phonon properties, we demonstrate that thermal conductivity cannot be quantum corrected on a system level. We explore the source of the differences in the quantum and classical phonon relaxation times on a mode-by-mode basis.

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)0.004
metaresearch head score (Gemma)0.020
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 score0.004
Threshold uncertainty score0.021

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0040.020
Meta-epidemiology (narrow)0.0010.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0010.000
Science and technology studies0.0010.002
Scholarly communication0.0010.002
Open science0.0010.001
Research integrity0.0010.001
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 head0.056
GPT teacher head0.370
Teacher spread0.315 · 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

Citations213
Published2009
Admission routes1
Has abstractyes

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