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DFT-enhanced machine learning for accurate PLQY prediction and inverse design of novel MR-TADF materials

Haochen Shi; Yiming Shi; Guangjun Zeng; Haichang Wang; Yumei Hu; Bo Qiao; Zhiqin Liang; Suling Zhao; Man-Chung Tang; Dandan Song
Chemical Engineering Journal · Vol. 525 · pp. 170146 · 2025
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Bibliographic Information

JournalChemical Engineering Journal
PublisherElsevier
Publication Date2025-12-01
Publication Year2025
Volume525
Pages170146
Document TypeJournal Article
eISSN1385-8947
DOI10.1016/j.cej.2025.170146
SubjectEnvironmental Science

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NARA Access Coverage1997-01-01~Current
Journal Homepagehttps://www.sciencedirect.com/science/journal/13858947
Publisher PageOpen Publisher Page
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