LCPQ/dft_tools
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1,311 Commits 10 Branches 20 Tags 84 MiB
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3 Commits

Author SHA1 Message Date
Nils Wentzell
e324b5728c Merge remote-tracking branch 'app4triqs-remote/unstable' into unstable 2022-11-18 15:34:08 -05:00
Nils Wentzell
58298e35ea Merge remote-tracking branch 'app4triqs-remote/3.1.x' into unstable 2022-02-28 15:18:51 -05:00
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