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Record W4404347368 · doi:10.1134/s1063774524601436

Dissymmetrization in Eudialyte-Group Minerals: 1. A Model of Ordered Cation Arrangement in the Crystal Structure of Amableite-(Ce) Using the P3 Symmetry

2024· article· en· W4404347368 on OpenAlex

Why this work is in the frame

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aboutThe title or abstract carries a Canadian signal from the geographic lexicon.
no affNo Canadian affiliation: this work is invisible to an affiliation-only frame.
No Canadian affiliation. An affiliation-only frame, the usual design, would never have seen this work. It is one of the works that make the case for inverting the frame.

Bibliographic record

VenueCrystallography Reports · 2024
Typearticle
Languageen
FieldMaterials Science
TopicCrystal Structures and Properties
Canadian institutionsnot available
Fundersnot available
KeywordsGroup (periodic table)CrystallographySymmetry (geometry)ChemistryCrystal structureMathematicsGeometry

Abstract

fetched live from OpenAlex

The crystal structure of a new mineral from the eudialyte group, amableite-(Ce) Na15[(Ce1.5Na1.5)Mn3]Mn2Zr3 $$\square $$ Si[Si24O69(OH)3](OH)2 ⋅ H2O, was refined using X-ray diffraction analysis in the R3 space group. This mineral was discovered in a hyperagpaitic pegmatite in the Saint-Amable massif, Canada. Amableite-(Ce) is a representative of the eudialyte group with the lowest calcium content; it differs from other representatives of this group by the dominance of lanthanides in a part of edge-sharing octahedra of the six-membered ring. The structure of amableite-(Ce) has a unit cell with the following parameters: a = 14.1340(2) Å, c = 30.378(1) Å, and V = 5255.6(3) Å3. In this paper, we propose a model for the distribution of cations within the amableite-(Ce) crystal structure based on a low-symmetry P3 space group. We refined 162 independent atomic positions in the isotropic–anisotropic approximation using 3968 reflections with F > 3σ(F) and obtained R = 4.6% as the final result. Despite the close agreement between the two space groups, the transition from R3 to P3 allows us to obtain a more detailed information about the local distribution of a number of elements over different framework sites. The models of the crystal structure of amableite-(Ce) in the framework of R3 and P3 symmetries, as well as other low-calcium minerals from the eudialyte group that have been studied previously within several space groups, have been compared.

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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: Bench or experimental · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.710
Threshold uncertainty score0.479

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.002
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0000.000

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 head0.021
GPT teacher head0.255
Teacher spread0.234 · 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