Search for dissertations about: "kinetic Monte Carlo"
Showing result 21 - 25 of 55 swedish dissertations containing the words kinetic Monte Carlo.
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21. New Materials for Spintronics : Electronic structure and magnetism
Abstract : Materials exhibiting new functionalities due to interdependent electric (e.g. conductivity) and magnetic properties are potentially interesting for spintronics applications. READ MORE
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22. Hydrogen Bonding in Liquid Alcohols
Abstract : Hydrogen bonded (H-bonded) materials, such as water, alcohols, sugars, and even DNA, are extremely important for biology, as well as chemical industry. Alcohols are used as solvents in paints, in perfumes, as cleaners, anti-freezers, or as an alternative to petrol in combustion engines. READ MORE
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23. Numerical solution of quasilinear kinetic diffusion equations in toroidal plasmas
Abstract : One of the main challenges for the realization of a working fusion power plant is an increased detailed understanding of kinetic phenomena in toroidal plasmas. The tokamak is a toroidal, magnetically confined plasma device and is currently the main line towards a power plant. READ MORE
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24. First-principles studies of kinetic effects in energy-related materials
Abstract : Quantum mechanical calculations based on first-principles (lat. ab initio) methods have over the past decades proved very successful for the study of many materials properties. READ MORE
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25. Structural, Kinetic and Thermodynamic Aspects of the Crystal Polymorphism of Substituted Monocyclic Aromatic Compounds
Abstract : This work concerns the interrelationship between thermodynamic, kinetic and structural aspects of crystal polymorphism. It is both experimental and theoretical, and limited with respect to compounds to substituted monocyclic aromatics. READ MORE