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Record W4414855831 · doi:10.1021/acsnano.5c11903

Direct and Sustainable Ammonia Synthesis from Air and Water with Sulfur-Deficient MoS<sub>2</sub> Piezocatalysts

2025· article· en· W4414855831 on OpenAlexaff
Yu‐Ching Chen, Yin‐Song Liao, Po‐Han Chen, Jyh‐Pin Chou, Cheng-Kuo Tsai, Yi-Dong Lin, Yan‐Gu Lin, Yu‐Ren Peng, Jyh Ming Wu

Bibliographic record

VenueACS Nano · 2025
Typearticle
Languageen
FieldEnergy
TopicAdvanced Photocatalysis Techniques
Canadian institutionsResponse Biomedical (Canada)
FundersNational Science and Technology CouncilMinistry of Education, India
KeywordsAntibonding molecular orbitalCatalysisDissociation (chemistry)Raman spectroscopyAmmonia productionDiffuse reflectance infrared fourier transformUnpaired electronDensity functional theoryAdsorption

Abstract

fetched live from OpenAlex

High Resolution Image Download MS PowerPoint Slide Eco-friendly ammonia (NH 3 ) production is critical for advancing sustainable agriculture and industry. This study introduces a sustainable, cleaner approach using MoS 2 nanoflowers (NFs) to synthesize NH 3 directly from water and air without the need for sacrificial agents. The advanced design leverages double sulfur vacancies (V2s) in MoS 2 NFs (V2s-MoS 2 NFs) and their piezoelectric properties, achieving a noteworthy production efficiency of 8374.8 ± 140.1 μmol L –1 g –1 h –1 (absolute production rate of 0.84 ± 0.01 μmol h –1 ). This outperforms most existing photocatalysts and piezocatalysts and rivals advanced electrocatalysts. The catalyst demonstrated exceptional stability, producing 36.55 mmol L –1 g –1 (equivalent to an absolute yield of 3.655 μmol) with N 2 and 26.03 mmol L –1 g –1 (equivalent to an absolute yield of 2.603 μmol) with air over 8 h. In situ Raman spectroscopy revealed intensifying peaks at ∼819 and 993 cm –1 under N 2 gas, attributed to Mo–N stretching vibrations. Additionally, in situ diffuse reflectance infrared Fourier-transform spectroscopy showed N 2 adsorption configurations, including side-on adsorption, indicative of N≡N bond elongation on the catalyst surface. Density functional theory calculations corroborated these findings, illustrating how unpaired Mo d orbital electrons near sulfur vacancies activate N 2 dissociation via backdonation to N 2 ’s antibonding π orbitals. This research highlights the transformative potential of piezocatalytic systems for nitrogen reduction reactions using atmospheric N 2 and water, providing a basis for sustainable energy solutions.

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 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 score0.016
Threshold uncertainty score0.896

Codex and Gemma teacher scores by category

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)0.0000.000

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 head0.004
GPT teacher head0.205
Teacher spread0.201 · 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.

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

Citations11
Published2025
Admission routes1
Has abstractyes

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