The chemical reactivity of molecules is a central theme in modern chemistry, guiding the design and synthesis of new compounds and materials. Density Functional Theory (DFT) has emerged as a robust, ...
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New study discovers unexpected role of 4f-orbital covalency in driving chemical reactivity
The willingness of the 4f orbitals of lanthanide metals to participate in chemical reactions is as rare as their presence in Earth's crust. A recent study, however, witnessed the 4f orbital in a ...
Controlling chemical reactions to generate new products is one of the biggest challenges in chemistry. Developments in this area impact industry, for example, by reducing the waste generated in the ...
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