Browsing by Author "Morán López, J. L."

Now showing items 1-4 of 4

    • Energetics and the magnetic state of Mn2 adsorbed on Au(111): Dimer bond distance dependence 
      López Moreno, S.; Mejía López, J.; Muñoz Sáez, Francisco; Calles, A.; Morán López, J. L. (Elsevier, 2016)
      In this work we present a theoretical study of the adsorption Mn-2 dimer on the Au(111) surface. Here we use the density functional theory to construct a map of adsorption energies, E-A, of Mn-2 on a Au(111) surface as a ...
    • First-principles study of Mn3 adsorbed on Au (111) and Cu(111) surfaces 
      Hernández Vázquez, E. E.; López Moreno, S.; Muñoz Sáez, Francisco Javier; Ricardo-Chávez, J. L.; Morán López, J. L. (Royal Soc Chemistry, England, 2021)
      A theoretical study of the Mn trimer adsorbed on the noble metal surfaces Au(111) and Cu(111) is reported. The calculations were performed using first-principles methods within the density functional theory and the generalized ...
    • First-principles theoretical investigation of monoatomic and dimer Mn adsorption on noble metal (111) surfaces 
      Muñoz, Francisco; Romero, Aldo H.; Mejía López, José; Morán López, J. L. (2012)
      A theoretical investigation of the adsorption of Mn single atoms and dimers on the (111) surface of Cu, Ag, and Au, within the framework of the density functional theory, is presented. First, the bulk and the clean ...
    • Properties of Fe8 - NCoN nanoribbons and nanowires: A DFT approach 
      Muñoz, Francisco; Altbir, D.; Kiwi Tichauer, Miguel; Morán López, J. L. (Elsevier, 2013)
      The structural configurations and magnetic properties of zig-zag nanoribbons and nanowires of Fe8−NCoN, for 0≤N≤8, are calculated within the density functional theory. Both, for the zig-zag nanoribbons and the nanowires, ...