mirror of
https://github.com/triqs/dft_tools
synced 2024-11-01 03:33:50 +01:00
34 lines
1007 B
ReStructuredText
34 lines
1007 B
ReStructuredText
|
.. _applications:
|
||
|
|
|
||
|
|
Applications based on TRIQS
|
||
|
|
===========================
|
||
|
|
|
||
|
|
|
||
|
|
Wien2TRIQS
|
||
|
|
----------
|
||
|
|
|
||
|
|
Wien2TRIQS is an interface to Wien2k for LDA+DMFT calculation. It allows
|
||
|
|
you to turn band-structure calculations obtained from the Wien2k package to
|
||
|
|
inputs to full-fledged LDA+DMFT calculations in a few lines!
|
||
|
|
|
||
|
|
More info `here <http://ipht.cea.fr/triqs/new/cthyb_matrix/contents.html>`_.
|
||
|
|
|
||
|
|
Hybridization-expansion matrix solver
|
||
|
|
-------------------------------------
|
||
|
|
|
||
|
|
The hybridization-expansion matrix solver allows to solve the generic problem
|
||
|
|
of a quantum impurity embedded in a conduction bath. It is based on a quantum
|
||
|
|
Monte Carlo algorithm that stochastically samples the diagrams of a
|
||
|
|
hybridization expansion of the partition function.
|
||
|
|
|
||
|
|
More info here
|
||
|
|
|
||
|
|
Hubbard I solver
|
||
|
|
----------------
|
||
|
|
|
||
|
|
This solver gives the Hubbard I solution of a quantum impurity problem,
|
||
|
|
i.e. it solves the atomic limit. This simple approximation allows to have
|
||
|
|
very quick answer even for large multiband systems.
|
||
|
|
|
||
|
|
More info here
|