Results 141 to 150 of about 32,814 (317)

Fuel Effects on Aviation Engine Emissions: A Chemical Reactor Network Modeling Study. [PDF]

open access: yesEnergy Fuels
Lopez-Pintor D   +6 more
europepmc   +1 more source

A Generalized Framework for Data‐Efficient and Extrapolative Materials Discovery for Gas Separation

open access: yesAdvanced Intelligent Discovery, EarlyView.
This study introduces an iterative supervised machine learning framework for metal‐organic framework (MOF) discovery. The approach identifies over 97% of the best performing candidates while using less than 10% of available data. It generalizes across diverse MOF databases and gas separation scenarios.
Varad Daoo, Jayant K. Singh
wiley   +1 more source

Initiation: A Critical Step for High Activity and Stability in Ni‐Based Methane Dry Reforming Catalysts Supported on θ‐Al2O3

open access: yesAngewandte Chemie, EarlyView.
A well‐defined Ni/θ‐Al2O3 catalyst prepared by surface organometallic chemistry exhibits sharp temperature‐dependent behavior in dry reforming of methane. At 850°C, a dynamic induction process forms a transient carbide‐like NiCx phase that enables continuous carbon removal and coke resistance, whereas at 800°C incomplete carbon insertion leads to ...
Wei Wang   +3 more
wiley   +2 more sources

Data‐Guided Photocatalysis: Supervised Machine Learning in Water Splitting and CO2 Conversion

open access: yesAdvanced Intelligent Discovery, EarlyView.
This review highlights recent advances in supervised machine learning (ML) for photocatalysis, emphasizing methods to optimize photocatalyst properties and design materials for solar‐driven water splitting and CO2 reduction. Key applications, challenges, and future directions are discussed, offering a practical framework for integrating ML into the ...
Paul Rossener Regonia   +1 more
wiley   +1 more source

Peat fires contribute disproportionately to Siberian fire carbon emissions. [PDF]

open access: yesSci Adv
Khairoun A   +9 more
europepmc   +1 more source

ChatCFD: A Large Language Model‐Driven Agent for End‐to‐End Computational Fluid Dynamics Automation with Structured Knowledge and Reasoning

open access: yesAdvanced Intelligent Discovery, EarlyView.
Chat computational fluid dynamics (CFD) introduces an large language model (LLM)‐driven agent that automates OpenFOAM simulations end‐to‐end, attaining 82.1% execution success and 68.12% physical fidelity across 315 benchmarks—far surpassing prior systems.
E Fan   +8 more
wiley   +1 more source

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