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mirror of https://github.com/triqs/dft_tools synced 2024-12-24 05:13:45 +01:00
dft_tools/test/python/plovasp/proj_group/two_site/LOCPROJ
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

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1 8 32 10 6.8338870 # of spin, # of k-points, # of bands, # of proj
ISITE: 1 R= 0.0000000 0.0000000 0.0000000 Hydrogen-like : dxy
ISITE: 1 R= 0.0000000 0.0000000 0.0000000 Hydrogen-like : dyz
ISITE: 1 R= 0.0000000 0.0000000 0.0000000 Hydrogen-like : dz2
ISITE: 1 R= 0.0000000 0.0000000 0.0000000 Hydrogen-like : dxz
ISITE: 1 R= 0.0000000 0.0000000 0.0000000 Hydrogen-like : dx2-y2
ISITE: 2 R= -0.5000000 -0.5000000 -0.5000000 Hydrogen-like : dxy
ISITE: 2 R= -0.5000000 -0.5000000 -0.5000000 Hydrogen-like : dyz
ISITE: 2 R= -0.5000000 -0.5000000 -0.5000000 Hydrogen-like : dz2
ISITE: 2 R= -0.5000000 -0.5000000 -0.5000000 Hydrogen-like : dxz
ISITE: 2 R= -0.5000000 -0.5000000 -0.5000000 Hydrogen-like : dx2-y2
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