[Wien] DOS of cubic structures

[Dominik Legut]

Dear Wien2k users,

recently, I have calculated DOS of Pb in its ground state fcc cubic
structure and decomposed it into the s, p, px, py, pz components according
to the line corresponding line of the *.qtl file. As in the cubic
structure the x, y and z directions are equivalent, I supposed that
the DOSs for px, py and pz states will also be the same. However, this
is not the case!

Why do the DOS p-contributions for px, py and pz states differ if one
has a cubic crystal? What files should I check  ?

I should appreciate any comment on that. Thanks!

Dominik Legut



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 Dominik Legut                               tel.+420/5/32290461
 Institute of Physics of Materials           fax.+420/5/41218657
 Academy of Sciences of the Czech Republic   email: legut at ipm.cz
 Zizkova 22, Brno
 CZ-616 62
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