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Record W2603364453 · doi:10.1021/acs.inorgchem.6b02098

Canted Antiferromagnetism on Rectangular Layers of Fe<sup>2+</sup> in Polymorphic CaFeSeO

2017· article· en· W2603364453 on OpenAlexaff
Kwing To Lai, A. C. Komarek, M. T. Fernández‐Díaz, Pi-Shan Chang, Sungjoon Huh, H. Rösner, Chang‐Yang Kuo, Zhiwei Hu, Tun-Wen Pi, Péter Adler, Vadim Ksenofontov, L. H. Tjeng, Martin Valldor

Bibliographic record

VenueInorganic Chemistry · 2017
Typearticle
Languageen
FieldMaterials Science
TopicIron-based superconductors research
Canadian institutionsUniversity of British Columbia
Fundersnot available
KeywordsAntiferromagnetismChemistryCrystallographyMagnetic susceptibilityNeutron diffractionMössbauer spectroscopyStoichiometryCondensed matter physicsCrystal structurePhysical chemistry

Abstract

fetched live from OpenAlex

From stoichiometric amounts of CaO, Fe, and Se, pure powders and single crystals of quaternary can be obtained by solid-state reaction and self-flux growth, respectively. The as-synthesized compound exhibits a polymorphic crystal structure, where the two modifications have different stacking sequences of layers. The two polymorphs have similar unit cells but different crystal symmetries ( Cmc 2 1 and Pnma ), of which the former is non-centrosymmetric. Fe is divalent (d 6 ) and high-spin, as proven by X-ray spectroscopy, Mössbauer spectroscopy, and powder neutron diffraction data. The latter two, in combination with magnetic susceptibility and specific heat data, reveal a long-range antiferromagnetic spin order ( T N = 160 K) with a minor spin canting. CaFeSeO is an electronic insulator, as confirmed by resistivity measurements and density functional theory calculations. The latter also suggest a relatively small energy difference between the two polymorphs, explaining their intimate intergrowth.

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)0.001
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Insufficient payload (model declined to judge)
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 score0.005
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.001
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 science0.0010.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0050.000

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 head0.273
Teacher spread0.252 · 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.

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

Citations7
Published2017
Admission routes1
Has abstractyes

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