Listar por tema "Nanographene"
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Article
Adsorption of a Ni single atom catalyst on a pristine nanographene (coronene) and H-H activation. A theoretical study of Ni-SAC (2024)
(Elsevier B.V., 2024)A computational study of a Ni atom in a coronene (Cor) molecule, as a model of a single-atom catalyst (SAC), was carried out using a DFT approach. The adsorption energy results of Ni on Cor (2.31–1.84 eV) are similar to ...