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Hermann Schnait da2eb26940
Bugfix in block_structure.py 
In the (rare) case that one has multiple shells with different number of orbitals (e.g. p-d-systems) the old code crashed when converting GFs from the second shell as matrix dimensions were not fitting (the tmp matrix was always created for the first shell).
 		2021-06-09 13:06:25 +02:00
.github Merge remote-tracking branch 'app4triqs-remote/3.0.x' into 3.0.x 2021-05-28 14:43:10 -04:00
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deps [cmake] Use FindGit.cmake in external_dependency.cmake, Improve error message on clone failure 2020-09-09 15:51:00 -04:00
doc update SVO tutorial for dft tools 3 2021-02-25 12:41:57 -05:00
fortran/dmftproj dmftproj: add option to specify band indices 2020-08-04 17:48:06 +02:00
packaging Merge remote-tracking branch 'app4triqs-remote/3.0.x' into unstable 2020-08-14 12:40:06 -04:00
python/triqs_dft_tools Bugfix in block_structure.py 2021-06-09 13:06:25 +02:00
share Merge remote-tracking branch 'app4triqs-remote/3.0.x' into unstable 2020-08-08 16:37:03 -04:00
test Fit tail explicitly in analyse_block_structure_from_gf2.py 2020-08-13 17:17:07 -04:00
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README.md

DFT_Tools - A TRIQS application for ab initio calculations

Copyright (C) 2011-2019: M. Aichhorn, L. Pourovskii, V. Vildosola and C. Martins Copyright (C) 2020: The Simons Foundation

  1. Documentation

You will find the documentation of this application under https://triqs.github.io/dft_tools/.

  1. Installation

The installation steps are described in https://triqs.github.io/dft_tools/2.1.x/install.html

  1. Version

You can find the version and release number of the application on the top of the CMakeLists.txt file in this directory.

  1. License

This application is free software: you can redistribute it and/or modify it under the terms of the GNU General Public License as published by the Free Software Foundation, either version 3 of the License, or (at your option) any later version (see http://www.gnu.org/licenses/).

It is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details.