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Record W2992699099 · doi:10.1103/physrevb.100.064105

Pressure-induced formation of rhodium zigzag chains in the honeycomb rhodate<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:msub><mml:mi>Li</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mi>RhO</mml:mi><mml:mn>3</mml:mn></mml:msub></mml:mrow></mml:math>

2019· article· lv· W2992699099 on OpenAlexfundno aff
Volker Hermann, Sananda Biswas, J. Ebad-Allah, F. Freund, Anton Jesche, Alexander A. Tsirlin, Michael Hanfland, D. I. Khomskiǐ, P. Gegenwart, Roser Valentí, C. A. Kuntscher

Bibliographic record

VenuePhysical review. B./Physical review. B · 2019
Typearticle
Languagelv
FieldPhysics and Astronomy
TopicAdvanced Condensed Matter Physics
Canadian institutionsnot available
FundersEuropean Synchrotron Radiation FacilityDeutsche ForschungsgemeinschaftEnvironmental Studies Research FundsAlexander von Humboldt-Stiftung
KeywordsZigzagTriclinic crystal systemMonoclinic crystal systemCrystallographyHydrostatic pressureMaterials scienceAnisotropyCrystal structurePhysicsChemistryThermodynamicsGeometryQuantum mechanicsMathematics

Abstract

fetched live from OpenAlex

We use powder x-ray diffraction to study the effect of pressure on the crystal structure of the honeycomb rhodate ${\mathrm{Li}}_{2}{\mathrm{RhO}}_{3}$. We observe low-pressure ($P<{P}_{c1}=6.5\phantom{\rule{0.16em}{0ex}}\mathrm{GPa}$) and high-pressure ($P>{P}_{c2}=14\phantom{\rule{0.16em}{0ex}}\mathrm{GPa}$) regions corresponding to the monoclinic $C2/m$ symmetry, while a phase mixture is observed at intermediate pressures. At $P>{P}_{c2}$, the honeycomb structure becomes distorted and features short Rh-Rh bonds forming zigzag chains stretched along the crystallographic $a$ direction. This is in contrast to dimerized patterns observed in triclinic high-pressure polymorphs of $\ensuremath{\alpha}\text{\ensuremath{-}}{\mathrm{Li}}_{2}{\mathrm{IrO}}_{3}$ and $\ensuremath{\alpha}\text{\ensuremath{-}}{\mathrm{RuCl}}_{3}$. Density-functional theory calculations at various pressure conditions reveal that the observed rhodium zigzag-chain pattern is not expected under hydrostatic pressure but can be reproduced by assuming anisotropic pressure conditions.

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)0.000
Version: metacan-v3-hybrid-931329e0061cValidation 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 score0.003
Threshold uncertainty score0.010

Distilled classifier scores by category (both heads)

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)0.0030.000

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 head0.020
GPT teacher head0.283
Teacher spread0.263 · 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 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

Citations14
Published2019
Admission routes1
Has abstractyes

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