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Record W4307575643 · doi:10.1002/admi.202201555

Mechanosynthesis of a Structurally Characterized, Well‐Defined Graphitic Phosphorus‐Linked Carbon Nitride (g‐PCN) with Water Splitting Activity

2022· article· en· W4307575643 on OpenAlex
Blaine G. Fiss, Georgia Douglas, M.J. Ferguson, Jorge Becerra, Jesús Valdez, Trong‐On Do, Tomislav Friščić, Audrey Moores

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.
fundA Canadian funder is recorded on the work.

Bibliographic record

VenueAdvanced Materials Interfaces · 2022
Typearticle
Languageen
FieldEnergy
TopicAdvanced Photocatalysis Techniques
Canadian institutionsUniversité LavalMcGill UniversityCentre in Green Chemistry and Catalysis
FundersCanada Foundation for InnovationUniversité Laval
KeywordsMaterials scienceGraphitic carbon nitridePowder diffractionX-ray photoelectron spectroscopyPhosphideMagic angle spinningChemical engineeringCyanuric chlorideSpectroscopyDensity functional theoryCarbon nitrideNitrideCrystallographyNanotechnologyNuclear magnetic resonance spectroscopyMetalCatalysisOrganic chemistryPhotocatalysisChemistryComputational chemistryMetallurgy

Abstract

fetched live from OpenAlex

Abstract Graphitic phosphorus‐linked triazine networks (g‐PCNs) are an emergent class of carbon nitride materials that have attracted attention for their potential role in developing metal‐free water splitting photocatalysts, but remain difficult to access due to complicated synthetic procedures based on long reaction times, high‐temperature annealing (above 500 °C), and poor structural understanding. Here, a mild, lower temperature approach for the synthesis of catalytically active g‐PCN through combining a room‐temperature mechanochemical reaction of sodium phosphide and cyanuric chloride with only 1 h annealing at 300 °C is presented. Notably, this mechanosynthesized material is sufficiently ordered to permit unprecedented structural characterization of a g‐PCN layered solid by combining solid‐state magic angle spinning, nuclear magnetic resonance spectroscopy, X‐ray photoelectron spectroscopy, powder X‐ray diffraction (PXRD), and transmission electron microscopy, supported by dispersion‐corrected density functional theory modeling. The excellent match of experimental 31 P MAS NMR and PXRD data with modeling of the structure based on phosphorus‐linked triazine network layers makes the herein described mechanochemically synthesized material the first example of a photocatalytically active, as well as structurally characterized, g‐PCN.

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.

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)0.000
metaresearch head score (Gemma)0.000
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
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0010.000
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0010.001
Research integrity0.0000.000
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 head0.007
GPT teacher head0.225
Teacher spread0.218 · 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