0d25aefc73
* typos and subbed check in spin polarized calculations for quantum espresso with a warning when computing the deltaN * fixed typos in comments * removed legacy mode maintaining only compatibility layer and switched to old (<3.10) python syntax * added target density output in mu finder for brent and newton, refactored tunit test for DC, changed some comments
DFT_Tools - A TRIQS application for ab initio calculations
Copyright (C) 2011-2019: M. Aichhorn, L. Pourovskii, V. Vildosola and C. Martins Copyright (C) 2020-2022: The Simons Foundation
- Documentation
You will find the documentation of this application under triqs.github.io/dft_tools.
- Installation
The installation steps are described in triqs.github.io/dft_tools/latest/install
- Version
You can find the version and release number of the application on the top of the CMakeLists.txt file in this directory.
- 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.