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