The understanding of fundamental atomic-level processes
often requires
well-defined model systems. The oxygen atom transfer from CO2 to a transition metal cation in the gas phase presents such a model
system. We investigate the reaction of Ta+ + CO2 for which the formation of TaO+ is highly efficient and
attributed to multistate reactivity. Here, we study the atomistic
dynamics of the oxygen atom transfer reaction by recording experimental
energy and angle differential cross sections by crossed beam velocity
map imaging supported by ab initio quantum chemical
calculations. Product ion velocity distributions are dominated by
signatures for indirect dynamics, despite the reaction being highly
exothermic. Product kinetic energy distributions show little dependence
on additional collision energy even with only four atoms involved,
which hints at dynamical trapping behind a submerged barrier.
Chromone offers two energetically almost equivalent docking sites for alcohol molecules, in which the hydroxyl group is hydrogen bonded to one of the free electron pairs of the carbonyl O...
scite is a Brooklyn-based organization that helps researchers better discover and understand research articles through Smart Citations–citations that display the context of the citation and describe whether the article provides supporting or contrasting evidence. scite is used by students and researchers from around the world and is funded in part by the National Science Foundation and the National Institute on Drug Abuse of the National Institutes of Health.