Abstract
Akin to the shell structures of atoms, shell-filling concepts from traditional valence bond theory can be applied to the description of cluster stability. In view of this, the result of a chemical interaction could be explained through the energy minimization attained when a cluster closes an incomplete electronic shell, either by direct ionization or through the formation of a covalent/ionic bond. Also, it has been widely recognized that cluster stability and reactivity are associated with a comprehensive picture involving geometric structure, electronic configuration and the resulted energetics, allowing for one atom to make a difference and active-sites cooperation as introduced in this chapter.
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Luo, Z., Khanna, S.N. (2020). Cooperative Active-Sites Mechanism. In: Metal Clusters and Their Reactivity. Springer, Singapore. https://doi.org/10.1007/978-981-15-9704-6_6
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