9 Commits

Author	SHA1	Message	Date
Manuel Zingl	3a78f18cfc	dmftproj: add option to specify band indices ... This adds another option and a mode flag in dmftproj: * third value in window line defines now the mode * new option to provide an energy window where all bands which are within the window (at least at one k-point) are taken into account for the projectors. * updates to documention to reflects those changes	2020-08-04 17:48:06 +02:00
Alexander Hampel	11d394fd5b	synchronize dfttools with app4triqs structure ... * moved the plovasp C++ code to c++/triqs_dft_tools/converters/vasp * added global header triqs_dft_tools/triqs_dft_tools.hpp * python dir based on single cmakelist file * registered C++ tests for plovasp * corrected imports for py3 tests for plovasp * corrected block order in sigma_from_file and srvo3_Gloc * exchanged ref files for sigma_from_file, srvo3_Gloc, SrVO3.ref.h5 * moved vasp converter bash scripts from dir shells to bin dir	2020-06-10 17:45:53 +02:00
aichhorn	59e176e64a	updated Wien2k warning in cmake	2018-06-18 11:12:29 +02:00
Manuel	76dff0f5a2	find lapack	2018-01-22 17:36:21 -05:00
Olivier Parcollet	ae548d48da	WIP	2017-12-07 15:56:05 +01:00
Manuel Zingl	8ecadc1167	Writing of .oubwin removed for dmftproj -band	2015-07-07 16:00:06 +02:00
Priyanka Seth	1a48a8afe1	Crucial fix to run_triqs template for parallel execution	2015-03-11 08:22:54 +01:00
Michel Ferrero	cd650884d3	Clean CMakeLists.txt	2013-08-07 16:30:09 +02:00
Olivier Parcollet	0e585ad9b4	First import. triqs 1.0 alpha1	2013-07-23 20:55:29 +02:00