Sökning: "density of states"

Visar resultat 6 - 10 av 391 avhandlingar innehållade orden density of states.

  1. 6. Foundation of Density Functionals in the Presence of Magnetic Field

    Författare :Andre Laestadius; Michael Benedicks; Trygve Helgaker; KTH; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; Current density functional theory; Hohenberg-Kohn theorems; paramagnetic current density functionals; Kohn-Sham theory; Levy-Lieb functional; variational principle; N-representable; degeneracy; Mathematics; Matematik;

    Sammanfattning : This thesis contains four articles related to mathematical aspects of Density Functional Theory.In Paper A, the theoretical justification of density methods formulated with current densities is addressed. It is shown that the set of ground-states is determined by the ensemble-representable particle and paramagnetic current density. LÄS MER

  3. 7. Creating and Probing Extreme States of Materials : From Gases and Clusters to Biosamples and Solids

    Författare :Bianca Iwan; Nicusor Timneanu; Janos Hajdu; Stacey Sorensen; Uppsala universitet; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; free-electron laser; ultrashort X-rays; non-equilibrium plasma; Coulomb explosion; isotope effect; hydrodynamic expansion; ion acceleration; high intensity lasers; ablation; time-of-flight spectroscopy; Fysik; Physics;

    Sammanfattning : Free-electron lasers provide high intensity pulses with femtosecond duration and are ideal tools in the investigation of ultrafast processes in materials. Illumination of any material with such pulses creates extreme conditions that drive the sample far from equilibrium and rapidly convert it into high temperature plasma. LÄS MER

  4. 8. Correlated Electronic Structure of Materials : Development and Application of Dynamical Mean Field Theory

    Författare :Patrik Thunström; Olle Eriksson; Alexander Lichtenstein; Uppsala universitet; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; DFT; DMFT; correlation; entanglement; Physics with spec. in Atomic; Molecular and Condensed Matter Physics; Fysik med inriktning mot atom- molekyl- och kondenserande materiens fysik;

    Sammanfattning : This thesis is dedicated to the development, implementation and application of a combination of Density Functional Theory and Dynamical Mean Field Theory. The resulting program is shown through several examples to be a powerful and flexible tool for calculating the electronic structure of strongly correlated materials. LÄS MER

  5. 9. Electrochromic Properties of Iridium Oxide Based Thin Films

    Författare :Jonas Backholm; Gunnar A. Niklasson; Andris Azens; Franco Decker; Uppsala universitet; []
    Nyckelord :Engineering physics; Electrochromism; iridium oxide; hydrogen intercalation; chemical diffusion coefficient; density of states; optical modulation; Teknisk fysik;

    Sammanfattning : Electrochromic iridium oxide (IrOx) and iridium-tantalum oxide (IrTaOx) thin films were prepared by reactive magnetron sputtering. Composition, density, and structure were determined using Rutherford backscattering spectroscopy, X-ray photoelectron spectroscopy, X-ray diffraction, scanning electron microscopy, transmission electron microscopy, and electron energy loss spectroscopy. LÄS MER

  7. 10. Radiative lifetimes of bound excited states in anions : Measurements on long-lived metastable states in atomic anions

    Författare :Odd Magnar Hole; Stockholms universitet; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; fysik; Physics;

    Sammanfattning : This thesis presents and discusses the results of measurements of the intrinsic lifetimes of bound excited anionic states. The results are valuable for evaluation of different theoretical models and computation methods and are compared to calculations when available. LÄS MER