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elk
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Elk Transport code and subsequent updates (#229)
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2023-01-04 17:16:57 -05:00 |
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plovasp
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fix: np.int / np.float / np. complex are depracted (np v1.20) / removed (np v1.24)
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2023-01-23 15:40:57 -05:00 |
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w90_convert
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Elk Transport code and subsequent updates (#229)
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2023-01-04 17:16:57 -05:00 |
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analyse_block_structure_from_gf2.py
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fix: np.int / np.float / np. complex are depracted (np v1.20) / removed (np v1.24)
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2023-01-23 15:40:57 -05:00 |
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analyse_block_structure_from_gf.py
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fix: np.int / np.float / np. complex are depracted (np v1.20) / removed (np v1.24)
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2023-01-23 15:40:57 -05:00 |
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analyse_block_structure_from_gf.ref.h5
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Merge branch 'unstable' into py3
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2020-06-23 10:53:52 +02:00 |
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basis_transformation.py
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reverting previous commit, not compatible with TRIQS/unstable
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2023-02-01 10:05:30 +01:00 |
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blockstructure.in.h5
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Elk Transport code and subsequent updates (#229)
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2023-01-04 17:16:57 -05:00 |
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blockstructure.py
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remove gf_struct_flatten function and replace with triqs version
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2022-03-09 09:15:10 -05:00 |
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blockstructure.ref.h5
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Merge branch 'unstable' into py3
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2020-06-23 10:53:52 +02:00 |
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CMakeLists.txt
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elk-interface bug fixes (#228)
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2022-11-10 11:11:28 -05:00 |
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hk_convert_hamiltonian.hk
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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hk_convert.py
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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hk_convert.ref.h5
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Elk Transport code and subsequent updates (#229)
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2023-01-04 17:16:57 -05:00 |
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sigma_from_file.py
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start changelog for unstable and fix python test
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2022-07-07 09:33:16 -04:00 |
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sigma_from_file.ref.h5
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrIrO3_rot.h5
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Elk Transport code and subsequent updates (#229)
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2023-01-04 17:16:57 -05:00 |
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srvo3_Gloc.py
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fixed tests to work with dev version of triqs
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2021-05-26 17:59:50 -04:00 |
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srvo3_Gloc.ref.h5
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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srvo3_spectral.py
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fix spaghettis function and update test
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2022-04-20 11:36:10 -04:00 |
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srvo3_spectral.ref.h5
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vectorize loop over frequencies in spaghettis
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2021-10-13 17:37:33 -04:00 |
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srvo3_transp.py
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fix transport test, allow for parallel execution of tests
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2022-04-20 11:36:10 -04:00 |
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srvo3_transp.ref.h5
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3_Sigma_transport.h5
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fix transport test, allow for parallel execution of tests
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2022-04-20 11:36:10 -04:00 |
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SrVO3_Sigma.h5
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3_spectral.h5
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Elk Transport code and subsequent updates (#229)
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2023-01-04 17:16:57 -05:00 |
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SrVO3.ctqmcout
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3.oubwin
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3.outputs
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3.parproj
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3.pmat
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3.ref.h5
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Elk Transport code and subsequent updates (#229)
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2023-01-04 17:16:57 -05:00 |
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SrVO3.struct
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3.sympar
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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SrVO3.symqmc
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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sumkdft_basic.py
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fix bugs and tests
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2022-04-20 11:36:10 -04:00 |
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sumkdft_basic.ref.h5
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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w90_convert_fermienergy.py
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Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
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2022-04-15 10:51:37 -04:00 |
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w90_convert_LaVO3.py
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Split wannier90 tests up
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2022-04-19 17:03:49 +02:00 |
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w90_convert_SrVO3_col.py
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Split wannier90 tests up
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2022-04-19 17:03:49 +02:00 |
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w90_convert_SrVO3_soc.py
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Fix for wannier converter: reordering of orbital/spin order only necessary for vasp 5
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2022-10-19 11:28:33 +02:00 |
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w90_convert_SrVO3_t2g_col.py
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Split wannier90 tests up
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2022-04-19 17:03:49 +02:00 |
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wien2k_convert.py
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synchronize dfttools with app4triqs structure
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2020-06-10 17:45:53 +02:00 |
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wien2k_convert.ref.h5
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Elk Transport code and subsequent updates (#229)
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2023-01-04 17:16:57 -05:00 |
