Benchmarking of density functional theory calculation approaches for activation barriers in halogen atom transfer reactions

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Authors: TianYi Chen, Chaoyue Zhao, Shuoqing Zhang, Xin Hong
Cited by: 3
References: 51

Fields of Study & Subjects

Radical Photochemical Reactions Catalytic C–H Functionalization Methods Oxidative Organic Chemistry Reactions

Publication details

Journal / source
Journal of Organometallic Chemistry
Publisher
Elsevier BV
Volume
1048
Pages
124013–124013
Publication date
22 January 2026
Language
EN