[Wien] DOS in a single k-pointitrary

[Gerhard Fecher]

rho(E) = 1/N_k sum delta( epsilon_i,k - E)
delta( epsilon_i,k - E) is 1 if you hit the state on the spaghetti and 0 if you do not hit it with youre k-point
that means for most of the arbitrary k-points at arbitrary energies the density of states is zero.

Ciao
Gerhard

====================================
Dr. Gerhard H. Fecher
Institut of Inorganic and Analytical Chemistry
Johannes Gutenberg - University
55099 Mainz
________________________________________
Von: wien-bounces at zeus.theochem.tuwien.ac.at [wien-bounces at zeus.theochem.tuwien.ac.at] im Auftrag von Oleg Artamonov [arto at mail.nnz.ru]
Gesendet: Donnerstag, 11. Dezember 2008 17:34
An: A Mailing list for WIEN2k users
Betreff: [Wien] DOS in a single k-pointitrary

Dear Wien2k users,

Perhaps, somebody has calculated the DOS in an arbitrary single
k-point or the DOS distribution along a line in the BZ.
How is it possible to do that in Wien2k?

Thanks in advance,
                Oleg Artamononov.

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