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Article(2)
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ODS 12: Producción y consumo responsables(2)
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scopus(2)
Atoms in molecules theory for exploring the nature of the MoS<inf>2</inf> catalyst edges sites
ArticleAbstract: The nature of the MoS2 catalyst edge was studied using the atoms in molecules theory. The network ofPalabras claves:Atoms in molecules theory, density functional theory, Molybdenum sulfide catalystAutores:Rodríguez J.A., Yosslen R. ArayFuentes:scopusNature of the NiMoS catalyst edge sites: An atom in molecules theory and electrostatic potential studies
ArticleAbstract: The nature of the active sites on the NiMoS catalyst was explored using the combination of the atomsPalabras claves:Atoms in molecules theory, DFT, Electrostatic potential, HDS, NiMoSAutores:Alba Beatriz Vidal, Coll S., Rodríguez J.A., Yosslen R. ArayFuentes:scopus