Anchoring the potential energy surface for the Br + H2O → HBr + OH reaction

Theoretical Chemistry Accounts

Volumn 133, Issue 8, 2014, Pages 1-9

  Zhang, Meiling ^a   Hao, Yanjun ^b   Guo, Yundong ^c   Xie, Yaoming ^d   Schaefer, Henry F ^d  

^a TIANJIN MEDICAL UNIVERSITY   (China)

^b SICHUAN UNIVERSITY   (China)

^c NEIJIANG NORMAL UNIVERSITY   (China)

^d UNIVERSITY OF GEORGIA   (United States)

Author keywords

Ab initio computations; Atmospheric chemistry; Bromine atoms; OH radicals; Potential energy surfaces; Water reactions

Indexed keywords

EID: 84956712350     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-014-1513-6     Document Type: Article

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