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Record W7116861021 · doi:10.1002/ctpp.70072

A Study of the Electronic and Ionic Structure, for Competing States of Fully and Partially Ionized Hydrogen, Using the Neutral Pseudo‐Atom Method as Well as a Classical Map for the Electron Subsystem

2025· article· en· W7116861021 on OpenAlexaff
M. W. C. Dharma‐wardana

Bibliographic record

VenueContributions to Plasma Physics · 2025
Typearticle
Languageen
FieldEarth and Planetary Sciences
TopicHigh-pressure geophysics and materials
Canadian institutionsUniversité de MontréalNational Research Council Canada
Fundersnot available
KeywordsIonizationThomson scatteringWarm dense matterElectronAb initioAb initio quantum chemistry methodsDensity functional theoryMeasure (data warehouse)Monte Carlo method

Abstract

fetched live from OpenAlex

ABSTRACT Prof. Bonitz and his collaborators have made seminal contributions to the study of the uniform electron fluid and the electron‐proton fluid, viz., hydrogen, in using ab initio simulations. as reflected in this festschrift. Here we review the theoretical methods available for these systems where traditional small‐parameter methods fail. We use the neutral‐pseudo atom (NPA) method, and a classical map for quantum electrons to study hydrogen plasmas. We show that both fully‐ionized and partially‐ionized hydrogen phases can exist with the same nominal density and temperature, at pressures and temperatures of interest to planetary physics. The mean ionization , pair‐distribution functions, free energies, pressures and conductivities are calculated for the competing phases. Here is also a measure of the miscibility of fully ionized and un‐ionized hydrogen. Recent studies using path‐integral Monte Carlo methods, and ‐atom Density Functional Theory (DFT) simulations have provided essential structure data including the electron–electron structure factor that enters into interpretation of x‐ray Thomson scattering and other diagnostics. We show that these structure data can be inexpensively evaluated using classical‐map schemes for fully ionized plasmas, and more generally, using one‐atom (average‐atom) DFT methods for partially ionized systems.

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)0.001
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: Theoretical or conceptual · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.383
Threshold uncertainty score0.497

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0010.000
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 head0.009
GPT teacher head0.281
Teacher spread0.272 · 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 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

Citations1
Published2025
Admission routes1
Has abstractyes

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