Articles with "kinetics statistical" as a keyword



OCS isomerization and dissociation kinetics from statistical models

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Published in 2018 at "Theoretical Chemistry Accounts"

DOI: 10.1007/s00214-018-2253-9

Abstract: AbstractIn this work computational modeling of the isomerization reactions of the linear OCS, CSO, COS, and the cyclic Δ-OCS structures, on the ground state Potential Energy Surface (PES), is performed using Rice–Ramsperger–Kassel–Marcus (RRKM), Semiclassical Transition… read more here.

Keywords: isomerization dissociation; ocs isomerization; dissociation; dissociation kinetics ... See more keywords