Titlebook: Atomic-Scale Modeling of Nanosystems and Nanostructured Materials; Carlo Massobrio,Hervé Bulou,Christine Goyhenex Book 2010 Springer-Verla

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Surface Diffusion on Inhomogeneous Surfaces,ations tools, such us structural optimization and molecular dynamics. We focus on heterogeneous combinations of transition metals substrate/adsorbate systems, motivated by experimental evidence pointing to non-trivial diffusion processes on short and extended spatial scales. The applications describ

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Electronic, Magnetic and Spectroscopic Properties of Vanadium, Chromium and Manganese Nanostructuren substrates or embedded in a host, mainly metallic. Those elements present a sizeable magnetic moment in their atomic form and non-ferromagnetic behaviour for the corresponding bulk materials. More precisely, vanadium, except in the atomic form and for very small cluster sizes (free or embedded), i

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Nanostructural Units in Disordered Network-Forming Materials and the Origin of Intermediate Range Oable atomic-scale modeling is ideally suited to complement experiments in the search of the microscopic origins of this behavior. A key to understand why these systems have specific structural properties is to focus on the nanostructural units by which they are composed. By analyzing the role played

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