[Wien] Dielectric constants of metal

Peter Blaha pblaha at zeus.theochem.tuwien.ac.at
Tue Dec 9 07:52:34 CET 2003


> I would like to try the calculation of dielectric constants with metallic
> occupation of fermi levels.
> How do I calculate with WIEN?

Using  "OPTICS". There's not much difference to insulators. Be carefull
with the TETRA method (see UG, chaper on optics) and include also
the intraband contribution.

                                      P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
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