Documentos de José Mejía-López | REDI

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Publisher: "Physical Chemistry Chemical Physics"

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Área temáticas

Química inorgánica(4)

Ingeniería y operaciones afines(3)

Química física(3)

Electricidad y electrónica(1)

Área de conocimiento

Ciencia de materiales(6)

Nanostructura(2)

Química física(1)

Teoría del funcional de la densidad(1)

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A charge optimized many-body potential for iron/iron-fluoride systems

Abstract: A classical interatomic potential for iron/iron-fluoride systems is developed in the framework of th

Palabras claves:

José Mejía-López, Romero A.H., Tangarife E.

Fe/Ni core/shell nanowires and nanorods: A combined first-principles and atomistic simulation study

Abstract: In recent years, construction and characterization of core-shell structures have attracted great att

Palabras claves:

José Mejía-López, López-Moreno S., Mazo-Zuluaga J., Velásquez É.A.

First-principles study of pressure-induced structural phase transitions in MnF<inf>2</inf>

Abstract: In this work we report a complete structural and magnetic characterization of crystalline MnF2 under

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José Mejía-López, López-Moreno S., Muñoz A., Romero A.H.

Low-energy configurations of Pt<inf>6</inf>Cu<inf>6</inf> clusters and their physical-chemical characterization: a high-accuracy DFT study

Abstract: Based on a combination of many-body potentials, an analysis of the inertia tensors and a Density Fun

Palabras claves:

José Mejía-López, Mazo-Zuluaga J., Velásquez É.A.

Physical-chemical properties of M@Fe<inf>3</inf>O<inf>4</inf> core@shell nanowires (M = Cu, Co, CoO)

Abstract: Interest in low dimensional magnetic systems has been growing due to the novel and dramatically diff

Palabras claves:

José Mejía-López, Mazo-Zuluaga J., Tangarife E.

Uniaxial magnetic anisotropy energy of bimetallic Co-Ni clusters from a first-principles perspective

Abstract: Along with the growing precision in the control of matter at increasingly smaller size scales, a fie

Palabras claves:

Ana Mejía-López, José Mejía-López, Mazo-Zuluaga J.