GROUP THEORY SYMBOL

GTTbParmExport

GTTbParmExport[parameter set,file,information]
exports a tight-binding parameter set for external packages.

DetailsDetails

  • Mathematica allows to construct names for the tight-binding parameters, close to the nomenclature used in the literature. This form is also used in GTPack. To use such parameter sets already stored in the database of GTPack in other packages, a simplified version of the parameter names is exported together with the corresponding values.
  • Due to this export function an additional typing of the parameters ca be avoided. The command connects GTPack and SimPack.

ExamplesExamplesopen allclose all

Basic Examples  (1)Basic Examples  (1)

First load the package:

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Click for copyable input

Set the directory and read the database.

In[2]:=
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Retrieve the parmater set of Cu from the database.

In[3]:=
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Out[3]=

Export the dataset to a file

In[4]:=
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Out[4]=
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