[Wien] DMFT

Roberto Iglesias roberto at uniovi.es
Mon Oct 13 15:00:37 CEST 2014



delamora <delamora at unam.mx> wrote:

>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(�) (DMFT)
>
>    I knew that TRIQS had DMFT, but it is not as easy to install.
>
>                Pablo
>________________________________________
>De: wien-bounces at zeus.theochem.tuwien.ac.at <wien-bounces at zeus.theochem.tuwien.ac.at> en nombre de Elias Assmann <elias.assmann at 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
>
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