Buscar
Mostrando ítems 1-4 de 4
Sin título
The nucleation energy of bimetallic MCu n clusters (MNi. Pd, Pt; n = 1-4) adsorbed on an F s center of the MgO(001) surface have been studied by first-principles method based on density functional theory and compared to ...
Theoretical design of stable small aluminium–magnesium binary clusters
We explore in detail the potential energy surfaces of the AlxMgy (x, y = 1–4) systems as case studies to test the utility and limitations of simple rules based on electron counts and the phenomenological shell model (PSM) ...