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CatPath‐GPT: A Mixture of Experts System for Computational Catalyst Design

SmartMat, Volume 7, Issue 2, April 2026.
CatPath‐GPT presents a mixture‐of‐experts framework for computational catalyst design by combining product prediction, calculation planning, and automated code generation. The system supports catalyst screening and mechanism analysis through literature‐informed reasoning and structure generation.
Xingyu Wang, Zihao Jiao, Ziyun Wang
wiley +1 more source

Modulating Metal–Oxygen Bond Energy by Valence State Engineering in 2D High Entropy Oxides for Enhanced Water Electrolysis

Carbon Energy, Volume 8, Issue 3, March 2026.
The competitive redox equilibrium among different elements in 2D HEO is regulated through temperature‐controlled pyrolysis of 2D HEHO, obtaining 2D HEO with a continuously adjustable valence state of Fe, Ni, Mo, Ru, and V elements, which modulate the strength of the metal–O bond and activate the LOM‐OVSM for OER.
Tian Wu +10 more
wiley +1 more source

Unlocking the Potential of Heterogeneous Single‐Atom Catalysts for Renewable Energy Systems: From Foundation to Application

Interdisciplinary Materials, Volume 5, Issue 2, Page 205-242, March 2026.
It presents a comprehensive and critical discussion of the recent progress, challenges, and future perspectives of heterogeneous single‐atom catalysts (SACs) for renewable energy systems. We critically examine the challenges associated with large‐scale synthesis, and real‐time characterization SACs and propose forward‐looking strategies based on high ...
Kai Chen +7 more
wiley +1 more source

Using government documents in open pedagogy: A method for engagement and building skills. [PDF]