Search for dissertations about: "Kai Nordlund"

Found 2 swedish dissertations containing the words Kai Nordlund.

  2. 1. Atomistic simulations of lattice defects

    Author : Mattias Forsblom; Grimvall Göran; Kai Nordlund; KTH; []
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; Theoretical physics; Teoretisk fysik; Physics; Fysik;

    Abstract : Mechanical properties of solids are governed by crystal imperfections. Computational materials science is largely concerned with the modelling of such defects, e.g. their formation, migration, and interaction energies. READ MORE

  4. 2. Surface and Interface Studies of ZnO using Reactive Dynamics Simulation

    Author : David Raymand; Kersti Hermansson; Daniel Spångberg; Kai Nordlund; Uppsala universitet; []
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; catalysis; molecular dynamics; force-fields; metal oxide; ZnO; dynamical effects on reactivity; Inorganic chemistry; Oorganisk kemi; Kemi med inriktning mot oorganisk kemi; Chemistry with specialization in Inorganic Chemistry;

    Abstract : About 90% of all chemicals are produced with the help of catalysts, substances with the ability to accelerate reactions without being consumed. Metal oxides play a prominent role in catalysis, since they are able to act reversibly in many chemical processes. Zink oxide (ZnO) is used to catalyse a number of industrially important reactions. READ MORE