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Record W3168227397 · doi:10.1021/acscatal.1c01447

Self-Optimized Metal–Organic Framework Electrocatalysts with Structural Stability and High Current Tolerance for Water Oxidation

2021· article· en· W3168227397 on OpenAlexafffund
Chaopeng Wang, Feng Yang, Hao Sun, Yurou Wang, Jun Yin, Zhenpeng Yao, Xian‐He Bu, Jian Zhu

Bibliographic record

VenueACS Catalysis · 2021
Typearticle
Languageen
FieldEnergy
TopicElectrocatalysts for Energy Conversion
Canadian institutionsUniversity of Toronto
FundersBasic Energy SciencesTianjin Municipal Science and Technology BureauCanada Foundation for InnovationNational Natural Science Foundation of ChinaHigher Education Discipline Innovation ProjectUniversity of TorontoGovernment of Ontario
KeywordsBimetallic stripOxygen evolutionMetal-organic frameworkCatalysisMaterials scienceIsostructuralChemical engineeringElectrolyteValence (chemistry)Water splittingElectrochemistryNanotechnologyMetalChemistryPhysical chemistryElectrodeCrystal structureCrystallographyMetallurgyAdsorption

Abstract

fetched live from OpenAlex

Metal–organic frameworks (MOFs) as electrocatalysts for oxygen evolution reaction (OER) typically suffer from fast degradation under harsh electrolyte conditions, impeding their practical use in industrial electrolyzers. Besides, the evolution of catalytic centers in MOFs and the related influence on their performance along the progress of reaction have rarely been studied. Here, we report a type of structurally stable bimetallic FeNi-MOF nanoarrays with self-optimized electrocatalytic activities in the oxygen production. Such a unique dynamic phenomenon is related with the gradual valence increments of Fe ions in MOFs, which trigger the continuous performance improvement before reaching an optimal steady state. Apart from the intact crystalline structures upon cycling, these FeNi-MOFs achieve low overpotentials of 239 and 308 mV at the current densities of 50 and 200 mA cm–2, respectively, and show durable operation for over 1033 h (>43 days) at 100 mA cm–2 and for another 200 h at 500 mA cm–2. A direct comparison of isostructural and single crystalline Fe-MOFs and Ni-MOFs resolves higher activities of Fe sites in the bimetallic MOFs, which are corroborated by theoretical calculations. The Fe–O bond covalency increment during Fe oxidation enhances the proton–electron transfers with the oxygen 2p-band closer to the Fermi level, thereby expediting the OER process. This work provides deep insights into the understanding of catalytic processes in heterometallic MOFs.

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)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow)
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 score0.013
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0000.001
Science and technology studies0.0000.000
Scholarly communication0.0000.001
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 head0.007
GPT teacher head0.216
Teacher spread0.210 · 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

Citations152
Published2021
Admission routes2
Has abstractyes

Explore more

Same venueACS CatalysisSame topicElectrocatalysts for Energy ConversionFrench-language works237,207