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Heterogeneous Formation of HONO Catalyzed by CO2

Deming Xia1, Xinran Zhang2,3, Jingwen Chen1

  • 1Key Laboratory of Industrial Ecology and Environmental Engineering (MOE), Dalian Key Laboratory on Chemicals Risk Control and Pollution Prevention Technology, School of Environmental Science and Technology, Dalian University of Technology, Dalian 116024, China.

Environmental Science & Technology
|July 29, 2021
PubMed

Keywords:
Born−Oppenheimer molecular dynamicsCO2HONOflow system experimentfree-energy samplingsquantum chemical calculations·OH

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