dcb47d6e27
During the Elk conversion process, two files, SYMCRYS.OUT and LATTICE.OUT, need to be read. However, after the Elk calculation is completed, there are some blank lines in these files, which leads to recognition failure of readElkfiles.py. By using line.strip(), non-blank lines can be directly read. |
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| .github | ||
| bin | ||
| c++ | ||
| deps | ||
| doc | ||
| fortran/dmftproj | ||
| packaging | ||
| python/triqs_dft_tools | ||
| share | ||
| test | ||
| .clang-format | ||
| .clang-tidy | ||
| .dockerignore | ||
| .gitignore | ||
| AUTHORS.txt | ||
| ChangeLog.md | ||
| CMakeLists.txt | ||
| COPYING.txt | ||
| Dockerfile | ||
| Jenkinsfile | ||
| LICENSE.txt | ||
| README.md | ||
| requirements.txt | ||
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.