LCPQ/dft_tools
3
0
Fork 0
mirror of https://github.com/triqs/dft_tools synced 2024-06-20 04:02:20 +02:00
Code Issues Releases Wiki Activity
358 Commits 17 Branches 20 Tags 84 MiB
Python 54.8%
Fortran 37.4%
Shell 5.7%
C++ 2.1%
911f127789
Go to file
Oleg E. Peil 911f127789 Ported C-style 'dos_tetra' to C++ 
In order to wrap the ATM routines by Python using TRIQS wrapping
tools it is necessary to modify the interface to 'dos_tetra3d'.
The major changes involved replacing direct NumPy arrays with
TRIQS arrays which can be converted to Python arrays using library
tools.

Also, some small changes were necessary to port the functions
from C99 complex numbers to C++ style.

CMakeList is added to automatize building of the ATM library.
2016-03-09 18:55:15 +01:00
c++/plovasp Ported C-style 'dos_tetra' to C++ 2016-03-09 18:55:15 +01:00
doc Added preliminary documentation on charge SC 2016-01-26 11:45:51 +01:00
fortran/dmftproj Writing of .oubwin removed for dmftproj -band 2015-07-07 16:00:06 +02:00
python Added output of local Hamiltonian 2016-02-09 13:48:39 +01:00
test [tests] update h5 files after vector writing change in triqs lib 2015-10-07 12:45:45 +02:00
CMakeLists.txt changed version to 1.4 2015-11-25 11:53:44 +01:00
dft_dmft_cthyb.py small fix to dft_dmft_cthyb.py 2015-08-03 16:40:39 +02:00
README.txt Small fix merged from gsabo request #4 2014-01-21 17:15:43 +01:00

README.txt 

Wien2TRIQS interface to Wien2k
Copyright (C) 2011-2013, M. Aichhorn, L. Pourovskii, V. Vildosola and C. Martins

1. Documentation

You will find the documentation of this application under
<http://ipht.cea.fr/triqs/applications/dft_tools/>.

2. Installation

The installation steps are described in
<http://ipht.cea.fr/triqs/applications/dft_tools/install.html>

3. Version

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

4. 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.