Unlocking azobenzene isomerization mechanisms via an LLM agent-driven workflow integrating simulation, experiment, and machine learning

Journal:

Chemical Science

Published:

2026-05-20

DOI:

10.1039/d5sc08794e

Affiliations:

4

Authors:

13

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Institutions	Authors	Share
State Key Laboratory of Precision and Intelligent Chemistry, USTC, China	5.833333	0.45
Hefei National Laboratory for Physical Sciences at the Microscale (HFNL), USTC, China	5.833333	0.45
Jishu Quantum, China	1.000000	0.08
University of Science and Technology of China (USTC), China	0.333333	0.03

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