Journal article

Bond dissociation energies for Fe 2 , Fe2O , and Fe 2 O 2 clusters determined through threshold photodissociation in a cryogenic ion trap

SJP Marlton, C Liu, P Watkins, JT Buntine, EJ Bieske

Journal of Chemical Physics | Published : 2023

Abstract

Understanding and controlling the chemical behavior of iron and iron oxide clusters requires accurate thermochemical data, which, because of the complex electronic structure of transition metal clusters, can be difficult to calculate reliably. Here, dissociation energies for Fe 2 + , Fe2O+, and Fe 2 O 2 + are measured using resonance enhanced photodissociation of clusters contained in a cryogenically cooled ion trap. The photodissociation action spectrum of each species exhibits an abrupt onset for the production of Fe+ photofragments from which bond dissociation energies are deduced for Fe 2 + (2.529 ± 0.006 eV), Fe2O+ (3.503 ± 0.006 eV), and Fe 2 O 2 + (4.104 ± 0.006 eV). Using previously ..

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University of Melbourne Researchers