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The reaction of O( 3 P) radical with HNO has been studied using the B3LYP method at 6-31++g** level. The computation results reveal that the reaction of O( 3 P) with HNO proceeds to the formation of an energy-rich intermediate IM1. Through isomerization or decomposition of IM1, three possible product channels have been found. For the three reaction channels, the geometries and the...
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