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Adsorption isotherms Magnetic properties and materials Nanoparticles Interfaces Iron compounds Gold nanoparticles Faceting Li-ion batteries Self-assembly Computer simulation Magnesium oxide Nanostructures Metal-insulator boundaries Clusters ANATASE Miscibility gap Numerical simulation studies Surface energy Alkaline cells Au-Co and Pt-Co alloys Vacancies crystal Aromatic ligands XRD Structure Platinum Spinel FTIR spectroscopy Antibacterial activity Surface reconstruction Carbon monoxide oxidation FTIR Atomistic simulations Pulsed laser deposition Atom emission NANOKIN code Raman spectroscopy Grazing incidence small angle X-ray scattering Ab initio calculations Nucleation Anisotropy Phospho-olivines Oxides SEMICONDUCTORS Cobalt 100 termination Local structure Lattice dynamics Raman spectra Ultra-thin films Nucleation and growth Amorphous silica 1ST-PRINCIPLES ALLOYS Carbon Magnetic properties of nanostructures B subtilis Wet synthesis XPS Lithium batteries ALPHA-AL2O3 0001 SURFACE Vortex gyrotropic motion AUGMENTED-WAVE METHOD Surface chemistry ADSORPTION Out-of-equilibrium dynamic properties Lithium-ion batteries MgO ALUMINA SURFACES III-V semiconductors X-ray diffraction Lithium compounds Heterogeneous catalysis Conduction bands ATOMS THIN-FILMS Scanning tunneling microscopy Alloy nanoparticles ATOMIC-STRUCTURE Iron Adsorption Water Ab initio thermodynamics Magnesium oxides Vibrational spectroscopy 2DEG Metals Density functional theory Auger spectroscopy BATTERIES Abinitio calculations Magnesium compounds Layered compounds Density functional calculations GISAXS Antimony Intercalation compounds Oxidation Model catalyst Thin films Magnetic properties