Structural and electronic properties of PtPd and PtNi nanoalloys

The lowest-energy structures of binary (PtPd) n , (PtNi) m , (PtNi 3 ) s , and (Pt 3 Ni) s nanoclusters, with n=2–28, m=2–20, and s=4–6, modeled by the many-body Gupta potential, were obtained by using a genetic-symbiotic algorithm. These structures were further relaxed within the density functional...

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Veröffentlicht in:	The European physical journal. D, Atomic, molecular and optical physics (Print) Atomic, molecular and optical physics (Print), 2009-04, Vol.52 (1-3), p.127-130
Hauptverfasser:	Radillo-Díaz, A., Coronado, Y., Pérez, L. A., Garzón, I. L.
Format:	Artikel
Sprache:	eng
Schlagworte:	Applications of Nonlinear Dynamics and Chaos Theory Atomic Atomic and molecular clusters Atomic and molecular physics Calculations and mathematical techniques in atomic and molecular physics (excluding electron correlation calculations) Cluster Reactivity and Nano-catalysis Communication, education, history, and philosophy Density-functional theory Electronic structure of atoms, molecules and their ions: theory Exact sciences and technology Molecular Optical and Plasma Physics Physical Chemistry Physics Physics and Astronomy Physics literature and publications Quantum Information Technology Quantum Physics Reactivity of clusters Spectroscopy/Spectrometry Spintronics Studies of special atoms, molecules and their ions clusters
Online-Zugang:	Volltext
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