Lowering of Reaction Rates by Energetically Favorable Hydrogen Bonding in the Transition State. Degradation of Biofuel Ketohydroperoxides by OH

Author:

Xing Lili12ORCID,Lian Liuchao1,Wang Zhandong3ORCID,Cheng Zhanjun4ORCID,He Yunrui1,Cui Jintao1,Truhlar Donald G.2ORCID

Affiliation:

1. Energy and Power Engineering Institute, Henan University of Science and Technology, Luoyang 471003, Henan, China

2. Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States

3. National Synchrotron Radiation Laboratory, University of Science and Technology of China, Hefei 230029, Anhui, China

4. School of Environmental Science and Engineering, Tianjin University, Tianjin 300072, China

Funder

U.S. Department of Energy

National Natural Science Foundation of China

Program of Hefei Science Center CAS

Publisher

American Chemical Society (ACS)

Subject

Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis

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