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https://github.com/triqs/dft_tools
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11d394fd5b
* 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
11 lines
173 B
Plaintext
11 lines
173 B
Plaintext
nq = 1
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ntypes = 1
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nions = [1]
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el_names = ['V']
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a_brav:
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[[-1.4939 1.4939 1.4939]
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[ 1.4939 -1.4939 1.4939]
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[ 1.4939 1.4939 -1.4939]]
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q_types:
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[array([[ 0., 0., 0.]])]
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