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Physical Review B - Condensed Matter and Materials Physics(2)
Journal of Magnetism and Magnetic Materials(1)
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scopus(7)
Low-energy configurations of Pt<inf>6</inf>Cu<inf>6</inf> clusters and their physical-chemical characterization: a high-accuracy DFT study
ArticleAbstract: Based on a combination of many-body potentials, an analysis of the inertia tensors and a Density FunPalabras claves:Autores:José Mejía-López, Mazo-Zuluaga J., Velásquez É.A.Fuentes:scopusMagnetic effects of interstitial hydrogen in nickel
ArticleAbstract: Hydrogen storage in materials is among the most relevant fields when thinking about energy conversioPalabras claves:ab initio calculations, Ferromagnetic nickel, Interstitial hydrogen, Metal hydrides, NiH x, Stoner modelAutores:Florez J., José Mejía-López, León A.M., Mazo-Zuluaga J., Vargas P., Velásquez É.A.Fuentes:scopusPhysical properties of quasi-one-dimensional MgO and Fe3 O4 -based nanostructures
ArticleAbstract: We have studied the properties of several representative one-dimensional structures - MgO nanowires,Palabras claves:Autores:Duque L.F., José Mejía-López, López-Moreno S., Mazo-Zuluaga J., Munoz F., Romero A.H.Fuentes:scopusUnderstanding the loss of electrochemical activity of nanosized LiMn<inf>2</inf>O<inf>4</inf> particles: a combined experimental and ab initio DFT study
ArticleAbstract: In the field of Li-ion batteries (LIBs), one prevalent expectation is that smaller sized electrode mPalabras claves:Autores:Biaggio S.R., Bocchi N., Del Río R., Falqueto J.B., José Mejía-López, Mazo-Zuluaga J., Rocha-Filho R.C., Silva D.P.B., Velásquez É.A.Fuentes:scopusSequential oxygen chemisorption on Fe<inf>13</inf> clusters: From first-principles to practical insights
ArticleAbstract: With the advent of more precise technologies allowing manipulation of matter at nanoscopic scales anPalabras claves:health and technical applications, iron clusters, magnetic anisotropy energy, oxygen chemisorption, physicalchemical and magnetic propertiesAutores:Ana Mejía-López, José Mejía-López, Mazo-Zuluaga J.Fuentes:scopusStructure and electronic properties of iron oxide clusters: A first-principles study
ArticleAbstract: In this study we present results of electronic structure calculations for some iron oxide clusters oPalabras claves:Autores:José Mejía-López, López-Moreno S., Mazo-Zuluaga J., Restrepo J., Romero A.H.Fuentes:scopusSurface anisotropy of a Fe<inf>3</inf>O<inf>4</inf> nanoparticle: A simulation approach
ArticleAbstract: On the basis of a three-dimensional classical Heisenberg model with nearest magnetic neighbor interaPalabras claves:Magnetite, Monte Carlo, Nanoparticles, Surface anisotropyAutores:José Mejía-López, Mazo-Zuluaga J., Restrepo J.Fuentes:scopus