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AI Agent

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From unstructured to structured: opportunities, risks and engineering practices for LLM-based data extraction in chemistry and materials

Weijian Chen, ...Daojian Cheng
Open Access Perspective DOI: 10.20517/aiagent.2026.06 2 Jun 2026
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A closed-loop universal catalyst design workflow ready for AI agents

Lin Chen, ...Shaoqi Zhan
Open Access Research Highlight DOI: 10.20517/aiagent.2026.12 28 May 2026
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An energy-efficient scheduling approach for wind-solar-hydrogen systems based on distributed reinforcement learning

Bo Zhang, ...Liang He
Open Access Original Article DOI: 10.20517/aiagent.2026.01 28 May 2026
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AI agents as co-designers of catalysts: a paradigm shift for designing Cu-based single-atom alloy catalysts in CO2 electroreduction

Alessandro Fortunelli
Open Access Research Highlight DOI: 10.20517/aiagent.2026.05 25 May 2026
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DigMethpy: an AI-empowered digital catalysis platform for methane pyrolysis molten catalyst design

Zihao Cheng, ...Yuanzheng Chen
Open Access Short Communication DOI: 10.20517/aiagent.2026.11 12 May 2026
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Cloud synthesis: a global closed-loop feedback powered by autonomous AI-driven catalyst design agent

Di Zhang, ...Hao Li
Open Access Commentary DOI: 10.20517/aiagent.2025.02 29 Sep 2025
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From descriptors to machine learning interatomic potentials: a review of AI-accelerated electrocatalyst design

Yueyang Lin, ...Pengfei Ou
Open Access Mini Review DOI: 10.20517/aiagent.2025.05 4 Nov 2025
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Accelerating multimetallic catalyst discovery with robotics and agentic AI

Jiayu Peng, ...Kritarth Dandapat
Open Access Commentary DOI: 10.20517/aiagent.2025.07 23 Nov 2025
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Volume 1, Issue 1
Warm Congratulations!
Distinguished professor Hao Li of Tohoku University, Japan, is appointed as the Founding Editor-in-Chief of the newly launched journal AI Agent
Cloud synthesis: a global closed-loop feedback powered by autonomous AI-driven catalyst design agent
Di Zhang, ...Hao Li
Open Access | Commentary | 29 Sep 2025
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From descriptors to machine learning interatomic potentials: a review of AI-accelerated electrocatalyst design
Yueyang Lin, ...Pengfei Ou
Open Access | Mini Review | 4 Nov 2025
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Accelerating multimetallic catalyst discovery with robotics and agentic AI
Jiayu Peng, ...Kritarth Dandapat
Open Access | Commentary | 23 Nov 2025
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Coming soon.

Volume 1, Issue 1
AI Agent
ISSN 3070-3719 (Online)
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