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Theoretical study of the reactions of hydrogen atom with methyl and ethyl hydroperoxides

Shi, G; Song, JO; Tian, PZ; Li, ZJ

Song, JO (corresponding author), Tianjin Univ, State Key Lab Engines, Tianjin 300350, Peoples R China.

MOLECULAR PHYSICS, 2021; 119 (11):

Abstract

An ab initio dynamic study of the reactions of H atom with CH3OOH and CH3CH2OOH was performed over the temperature range of 250-1500K. The geometries ......

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