ArticleAdvanced science (Weinheim, Baden-Wurttemberg, Germany)2026
A Machine Learning-Driven Pore-Scale Network Model Coupling Reaction Kinetics and Interparticle Transport for Catalytic Process Design.
Article in Advanced science (Weinheim, Baden-Wurttemberg, Germany), 2026. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 1 paper.
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The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.
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Who cites it
1 citing paper in PubMed.
- A Machine Learning-Driven Pore-Scale Network Model Coupling Reaction Kinetics and Interparticle Transport for Catalytic Process Design.Advanced science (Weinheim, Baden-Wurttemberg, Germany) · 2026Article
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Authors and funding
11 authors.
Funding
Abstract
A pore-scale dual-network model is presented with kinetics (DNMK), enhanced by machine learning (ML), for efficient multiscale modeling of reaction-transport coupled catalytic processes in porous systems. In such systems, apparent catalytic performance arises from the intricate interplay between intrinsic microkinetics and inter-particle transport phenomena. By explicitly resolving these coupled effects, DNMK provides mechanistic insight into how spatial particle arrangements and transport limitations govern overall reactor performance. A key innovation of this work is the integration of ML-based surrogates to accelerate the microkinetic module, effectively bridging the large spatial and temporal scale mismatches between transport and catalytic reactions. This hybrid approach achieves up to a 750-fold computational speed-up while preserving full physical and chemical fidelity. The framework is demonstrated for sorption-enhanced CO
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Registered trials
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