Dear Elias, Thank you for your prompt reply, I was confused because, in the Introduction to optical properties with WIEN2k in the independent particle approximation (E. Assmann)) In the wien2wannier Features
you put the lines includes self-energy Sum(ω) (DMFT) I knew that TRIQS had DMFT, but it is not as easy to install. Pablo ________________________________________ De: wien-boun...@zeus.theochem.tuwien.ac.at <wien-boun...@zeus.theochem.tuwien.ac.at> en nombre de Elias Assmann <elias.assm...@gmail.com> Enviado: lunes, 13 de octubre de 2014 03:23 a.m. Para: A Mailing list for WIEN2k users Asunto: Re: [Wien] DMFT Hi Pablo, On 10/13/2014 03:55 AM, delamora wrote: > I want to include the DMFT into the calculations and apparently > wannier90 does this type of calculations, but I cannot see how to do them. > The wannier90 user-guide does not even mention DMFT. > Is there a guide for these type of calculations? Wannier90 does not do DMFT; to use the MLWFs from Wannier90 as a basis for DMFT is one of the many applications you might use MLWFs for. In the interest of completeness, I will just mention two DMFT implementations that are often used with Wien2k: TRIQS, and its Wien2k interface Wien2TRIQS <http://ipht.cea.fr/triqs/1.1/applications/dft_tools/index.html>; and w2dynamics, <http://www.physik.uni-wuerzburg.de/en/institute_einrichtungen/department_of_theoretical_physics_and_astrophysics/theoretische_physik_i/tp_i/mitarbeiter/prof_dr_giorgio_sangiovanni/> Elias _______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html _______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html