[Pw_forum] DOS: tetrahedron method + spin-orbit coupling

Paolo Giannozzi giannozz at democritos.it
Thu Mar 3 12:42:44 CET 2011


On Mar 3, 2011, at 9:49 , Iurii TIMROV wrote:

> I have met the problem in the calculation of the density of states  
> with
> the tetrahedron method, when the spin-orbit effect is included.

I think it is not currently implemented and requires some changes
to the code

P.
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Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222







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