GOBands

GOBands
is an option to select a number of bands for the calculation of the density of states.

DetailsDetails

  • The bands are simply selected by number. A real calculation of the partial DOS is not included jet.
  • Typical values for GOBands are:
  • "All"all bands are included
    nbands 1 ,..., n are included
    {i,j,...,k}only band i, j, ..., k are included
  • This option is used by: GTDensityOfStates bullet GTDensityOfStatesPlot

ExamplesExamplesopen allclose all

Basic Examples  (2)Basic Examples  (2)

First load the package:

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The density of stes of GaAs is used as an example. The DOS is first calculated in k-space. The Hamiltonian for the calculation is already prepared. The Hamiltonian is prepared with a sp^3s^* basis.

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The density of states in k-space can be calculated now.

All bands are included

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The first 4 bands are included

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