mirror of
https://github.com/triqs/dft_tools
synced 2024-06-29 08:24:54 +02:00
85 lines
1.0 KiB
ReStructuredText
85 lines
1.0 KiB
ReStructuredText
.. module:: triqs_dft_tools
|
|
|
|
.. _documentation:
|
|
|
|
Documentation
|
|
=============
|
|
|
|
Basic notions
|
|
-------------
|
|
|
|
.. toctree::
|
|
:maxdepth: 1
|
|
|
|
basicnotions/first
|
|
basicnotions/dft_dmft
|
|
basicnotions/structure
|
|
|
|
|
|
Construction of local orbitals from DFT
|
|
---------------------------------------
|
|
|
|
.. toctree::
|
|
:maxdepth: 2
|
|
|
|
guide/conversion
|
|
h5structure
|
|
|
|
|
|
DFT+DMFT
|
|
--------
|
|
|
|
.. toctree::
|
|
:maxdepth: 2
|
|
|
|
guide/dftdmft_singleshot
|
|
guide/dftdmft_selfcons
|
|
|
|
Advanced Topics
|
|
---------------
|
|
|
|
.. toctree::
|
|
:maxdepth: 1
|
|
|
|
guide/blockstructure
|
|
guide/BasisRotation
|
|
guide/soc
|
|
|
|
Postprocessing
|
|
--------------
|
|
|
|
.. toctree::
|
|
:maxdepth: 1
|
|
|
|
guide/analysis
|
|
guide/transport
|
|
|
|
|
|
Reference manual
|
|
----------------
|
|
|
|
This is the reference manual for the python routines.
|
|
|
|
.. autosummary::
|
|
:recursive:
|
|
:toctree: _python_api
|
|
:template: autosummary_module_template.rst
|
|
|
|
block_structure
|
|
converters
|
|
sumk_dft
|
|
sumk_dft_tools
|
|
symmetry
|
|
trans_basis
|
|
util
|
|
|
|
|
|
|
|
FAQs
|
|
----
|
|
|
|
.. toctree::
|
|
:maxdepth: 2
|
|
|
|
faqs/faqs
|