Hands-on session. Complete characterization of a material. The case of SrTiO3

Updated May 2016

  1. Lattice constant and bulk modulus
    PowerPoint Version     pdf Version     Pseudos, input, and README

  2. Band structure
    PowerPoint Version     pdf Version     Pseudos, input, and README

  3. Density of States and Projected Density of States
    PowerPoint Version     pdf Version     Pseudos, input, and README

  4. Fat bands
    PowerPoint Version     pdf Version     Pseudos, input, and README

  5. Born effective charges
    PowerPoint Version     pdf Version     Pseudos, input, and README

  6. Interface with WANNIER90
    PowerPoint Version     pdf Version     Pseudos, input, and README

  7. Plot the Fermi surface for electron and hole-doped SrTiO3
    PowerPoint Version     pdf Version     Pseudos, input, and README


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