Sökning: "Fysik med inriktning mot atom- molekyl- och kondenserande materiens fysik"
Visar resultat 1 - 5 av 70 avhandlingar innehållade orden Fysik med inriktning mot atom- molekyl- och kondenserande materiens fysik.
1. Atomic Scale Design of Clean Energy Materials : Efficient Solar Energy Conversion and Gas Sensing
Sammanfattning : The focus of this doctoral thesis is the atomic level design of photocatalysts and gas sensing materials. The band gap narrowing in the metal oxides for the visible-light driven photocatalyst as well as the interaction of water and gas molecules on the reactive surfaces of metal oxides and the electronic structure of kaolinite has been studied by the state-of-art calculations. LÄS MER
2. The Electronic Structure of Organic Molecular Materials : Theoretical and Spectroscopic Investigations
Sammanfattning : In the present thesis the electronic properties of two organic molecules were studied by means of density functional theory (DFT) in connection to their possible applications in organic photovoltaics and molecular spintronics respectively.The first analysed system is the C60 derivative PCBM extensively used in polymer solar cells for the charge separation process. LÄS MER
Sammanfattning : Graphene, the thinnest material with a stable 2D structure, is a potential alternative for silicon-based electronics. However, zero band gap of graphene causes a poor on-off ratio of current thus making it unsuitable for logic operations. This problem prompted scientists to find other suitable 2D materials. LÄS MER
Sammanfattning : Surfaces that are nanopatterned, metallic, and magnetic can support surface plasmon resonances, providing an alternative and effective way to reconfigure flat optical components. Utilising a range of near- and far-field characterisation techniques, the optical and magneto-optical properties of lithographically patterned thin magnetic films are investigated. LÄS MER
5. Probing Magnetism at the Atomic Scale: Non-Equilibrium Statistical Mechanics Theoretical Treatise
Sammanfattning : Here, I present a theoretical study, based on non-equilibrium quantum statistical mechanics and on the non-equilibrium extension to the RKKY intveraction,where I investigate the emergence of magnetism at the atomic scale in adsorbed molecular complexes hosting localized spin moments, at the stake of being probed with scanning tunneling microscopy tip, and being driven by a temperature gradient and gated by an electric field. The scanning tunneling microscopy set up is modeled as a molecular junction with a magnetic molecule embedded within it, where the molecule consists in a set of electronic levels resembling the typical s-p orbitals of a metal hydride or an organometal, and a localized spin moment resembling the magnetic unit hosted by the latter and former type of molecules mentioned. LÄS MER