[Wien] Could I select the kinetic, coulomb and exchange parts from one eigenvalue?

Peter Blaha pblaha at zeus.theochem.tuwien.ac.at
Tue Jan 25 08:49:55 CET 2005


Even when you repeat your question several times, I doubt that anybody
understands your request. At least, I do not know what exactly you want to
know.

>        I want to get the kinetic part,coulomb potential part and exchange correlation part from the total eigenvalues.
> such as the valence max of Gamma point. Who can tell me how to do it?
> 
> Best wish to you!
> 
> Yonghua


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