Sökning: "Walter Temmerman"

Hittade 2 avhandlingar innehållade orden Walter Temmerman.

  1. 1. Theory of Crystal Fields and Magnetism of f-electron Systems

    Författare :Massimiliano Colarieti Tosti; Olle Eriksson; Walter Temmerman; Uppsala universitet; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; NATURVETENSKAP; NATURAL SCIENCES; Theoretical physics; Crystal Field; Magnetism; Electronic Structure; Teoretisk fysik; Physics; Fysik;

    Sammanfattning : A parameter free approach for the calculation of the crystal field splitting of the lowest Russel-Saunders J-multiplet in f-electron systems has been developed and applied to selected compounds. The developed theory is applicable to general symmetries and is based on symmetry constrained density functional theory calculations in the local density or in the generalised gradient approximation. LÄS MER

  3. 2. Computational Material Design : Diluted Magnetic Semiconductors for Spintronics

    Författare :Lunmei Huang; Rajeev Ahuja; Walter Temmerman; Uppsala universitet; []
    Nyckelord :Physics; Density functional theory; Diluted magnetic semiconductor; Ferromagnetism; Defect; Phase transition; High pressure; Thermal elastic constant; Fysik;

    Sammanfattning : The present thesis deals with the application of ab-initio electronic structure calculations based on density functional theory for material design.The correlation between magnetic properties and electronic structures has been investigated in detail for diluted magnetic semiconductors (DMS), which have promising application for spintronics devices. LÄS MER