mirror of
https://github.com/triqs/dft_tools
synced 2025-01-05 10:59:34 +01:00
change python build directory
so that we can use the real include in the tests
This commit is contained in:
parent
3f569a810e
commit
8f1011e389
CMakeLists.txt
test
analyse_block_structure_from_gf.pyanalyse_block_structure_from_gf2.pyblockstructure.pyhk_convert.pysigma_from_file.pysrvo3_Gloc.pysrvo3_transp.pysumkdft_basic.pyw90_convert.pywien2k_convert.py
plovasp
atm
inpconf
test_general.pytest_groups.pytest_input.pytest_parameter_set.pytest_shells.pytest_special_parsers.py
plocar_io
plotools
proj_group
proj_shell
vaspio
@ -45,7 +45,7 @@ add_subdirectory(fortran/dmftproj)
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message(STATUS "TRIQS : Adding compilation flags detected by the library (C++11/14, libc++, etc...) ")
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add_subdirectory(c++)
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add_subdirectory(python)
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add_subdirectory(python python/triqs_dft_tools)
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add_subdirectory(shells)
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#------------------------
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@ -1,5 +1,5 @@
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from pytriqs.gf import *
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from sumk_dft import SumkDFT
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from triqs_dft_tools.sumk_dft import SumkDFT
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from scipy.linalg import expm
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import numpy as np
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from pytriqs.utility.comparison_tests import assert_gfs_are_close, assert_arrays_are_close, assert_block_gfs_are_close
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@ -1,5 +1,5 @@
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from pytriqs.gf import *
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from sumk_dft import SumkDFT
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from triqs_dft_tools.sumk_dft import SumkDFT
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import numpy as np
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from pytriqs.utility.comparison_tests import assert_block_gfs_are_close
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@ -1,8 +1,8 @@
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from sumk_dft import *
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from triqs_dft_tools.sumk_dft import *
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from pytriqs.utility.h5diff import h5diff
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from pytriqs.gf import *
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from pytriqs.utility.comparison_tests import assert_block_gfs_are_close
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from block_structure import BlockStructure
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from triqs_dft_tools.block_structure import BlockStructure
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SK = SumkDFT('blockstructure.in.h5',use_dft_blocks=True)
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@ -25,7 +25,7 @@ from pytriqs.archive import *
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from pytriqs.utility.h5diff import h5diff
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import pytriqs.utility.mpi as mpi
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from converters import *
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from triqs_dft_tools.converters import *
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Converter = HkConverter(filename='hk_convert_hamiltonian.hk',hdf_filename='hk_convert.out.h5')
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@ -2,7 +2,7 @@
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import os
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import numpy as np
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from converters.plovasp.atm import dos_tetra_weights_3d
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from triqs_dft_tools.converters.plovasp.atm import dos_tetra_weights_3d
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import mytest
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################################################################################
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import arraytest
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import numpy as np
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from converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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################################################################################
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#
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import arraytest
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import numpy as np
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from converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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################################################################################
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#
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import arraytest
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import numpy as np
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from converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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################################################################################
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#
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import arraytest
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import numpy as np
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from converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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################################################################################
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#
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import arraytest
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import numpy as np
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from converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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################################################################################
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#
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import arraytest
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import numpy as np
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from converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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################################################################################
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#
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@ -3,7 +3,7 @@ Tests of 'read_plocar()' from module 'plocar_io.c_plocar_io'
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"""
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import mytest
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import numpy as np
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from plocar_io.c_plocar_io import read_plocar
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from triqs_dft_tools.plocar_io.c_plocar_io import read_plocar
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################################################################################
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#
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@ -1,8 +1,8 @@
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import converters.plovasp.vaspio
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from converters.plovasp.inpconf import ConfigParameters
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from converters.plovasp.plotools import check_data_consistency
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from converters.plovasp.elstruct import ElectronicStructure
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import triqs_dft_tools.converters.plovasp.vaspio
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.plotools import check_data_consistency
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from triqs_dft_tools.converters.plovasp.elstruct import ElectronicStructure
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import mytest
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################################################################################
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@ -4,9 +4,9 @@ import rpath
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_rpath = os.path.dirname(rpath.__file__) + '/'
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import numpy as np
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from converters.plovasp.inpconf import ConfigParameters
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from converters.plovasp.proj_shell import ProjectorShell
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from converters.plovasp.proj_group import ProjectorGroup
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.proj_shell import ProjectorShell
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from triqs_dft_tools.converters.plovasp.proj_group import ProjectorGroup
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import mytest
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################################################################################
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@ -4,11 +4,11 @@ import rpath
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_rpath = os.path.dirname(rpath.__file__) + '/'
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import numpy as np
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from converters.plovasp.vaspio import VaspData
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from converters.plovasp.elstruct import ElectronicStructure
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from converters.plovasp.inpconf import ConfigParameters
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from converters.plovasp.proj_shell import ProjectorShell
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from converters.plovasp.proj_group import ProjectorGroup
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from triqs_dft_tools.converters.plovasp.vaspio import VaspData
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from triqs_dft_tools.converters.plovasp.elstruct import ElectronicStructure
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.proj_shell import ProjectorShell
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from triqs_dft_tools.converters.plovasp.proj_group import ProjectorGroup
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from pytriqs.archive import HDFArchive
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import mytest
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@ -4,11 +4,11 @@ import rpath
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_rpath = os.path.dirname(rpath.__file__) + '/'
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import numpy as np
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from converters.plovasp.vaspio import VaspData
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from converters.plovasp.elstruct import ElectronicStructure
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from converters.plovasp.inpconf import ConfigParameters
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from converters.plovasp.proj_shell import ProjectorShell
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from converters.plovasp.proj_group import ProjectorGroup
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from triqs_dft_tools.converters.plovasp.vaspio import VaspData
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from triqs_dft_tools.converters.plovasp.elstruct import ElectronicStructure
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.proj_shell import ProjectorShell
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from triqs_dft_tools.converters.plovasp.proj_group import ProjectorGroup
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import mytest
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################################################################################
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@ -4,11 +4,11 @@ import rpath
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_rpath = os.path.dirname(rpath.__file__) + '/'
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import numpy as np
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from converters.plovasp.vaspio import VaspData
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from converters.plovasp.elstruct import ElectronicStructure
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from converters.plovasp.inpconf import ConfigParameters
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from converters.plovasp.proj_shell import ProjectorShell
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from converters.plovasp.proj_group import ProjectorGroup
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from triqs_dft_tools.converters.plovasp.vaspio import VaspData
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from triqs_dft_tools.converters.plovasp.elstruct import ElectronicStructure
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.proj_shell import ProjectorShell
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from triqs_dft_tools.converters.plovasp.proj_group import ProjectorGroup
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from pytriqs.archive import HDFArchive
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import mytest
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@ -4,11 +4,11 @@ import rpath
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_rpath = os.path.dirname(rpath.__file__) + '/'
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import numpy as np
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from converters.plovasp.vaspio import VaspData
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from converters.plovasp.elstruct import ElectronicStructure
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from converters.plovasp.inpconf import ConfigParameters
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from converters.plovasp.proj_shell import ProjectorShell
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from converters.plovasp.proj_group import ProjectorGroup
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from triqs_dft_tools.converters.plovasp.vaspio import VaspData
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from triqs_dft_tools.converters.plovasp.elstruct import ElectronicStructure
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from triqs_dft_tools.converters.plovasp.inpconf import ConfigParameters
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from triqs_dft_tools.converters.plovasp.proj_shell import ProjectorShell
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from triqs_dft_tools.converters.plovasp.proj_group import ProjectorGroup
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import mytest
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################################################################################
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import mytest
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import numpy as np
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from converters.plovasp.vaspio import Doscar
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from triqs_dft_tools.converters.plovasp.vaspio import Doscar
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################################################################################
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#
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import mytest
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import numpy as np
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from converters.plovasp.vaspio import Eigenval
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from triqs_dft_tools.converters.plovasp.vaspio import Eigenval
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################################################################################
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#
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import mytest
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import numpy as np
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from converters.plovasp.vaspio import Kpoints
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from triqs_dft_tools.converters.plovasp.vaspio import Kpoints
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################################################################################
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#
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@ -7,7 +7,7 @@ _rpath = os.path.dirname(rpath.__file__) + '/'
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import mytest
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import numpy as np
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from converters.plovasp.vaspio import Poscar
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from triqs_dft_tools.converters.plovasp.vaspio import Poscar
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################################################################################
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#
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@ -22,7 +22,7 @@
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from pytriqs.archive import *
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from pytriqs.gf import *
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from pytriqs.gf.tools import *
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from sumk_dft_tools import *
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from triqs_dft_tools.sumk_dft_tools import *
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from pytriqs.utility.comparison_tests import *
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import numpy as np
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@ -21,8 +21,8 @@
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from pytriqs.archive import *
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from pytriqs.gf import *
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from sumk_dft import *
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from converters.wien2k_converter import *
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from triqs_dft_tools.sumk_dft import *
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from triqs_dft_tools.converters.wien2k_converter import *
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from pytriqs.operators.util import set_operator_structure
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from pytriqs.utility.comparison_tests import *
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from pytriqs.utility.h5diff import h5diff
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################################################################################
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from numpy import *
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from converters.wien2k_converter import *
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from sumk_dft import *
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from sumk_dft_tools import *
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from triqs_dft_tools.converters.wien2k_converter import *
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from triqs_dft_tools.sumk_dft import *
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from triqs_dft_tools.sumk_dft_tools import *
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from pytriqs.utility.comparison_tests import *
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from pytriqs.utility.h5diff import h5diff
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################################################################################
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from pytriqs.archive import *
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from sumk_dft_tools import SumkDFTTools
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from triqs_dft_tools.sumk_dft_tools import SumkDFTTools
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import pytriqs.utility.mpi as mpi
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from pytriqs.utility.comparison_tests import *
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from pytriqs.utility.h5diff import h5diff
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################################################################################
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from converters import *
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from triqs_dft_tools.converters import *
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from pytriqs.archive import *
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from pytriqs.utility.h5diff import h5diff
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import pytriqs.utility.mpi as mpi
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@ -25,7 +25,7 @@ from pytriqs.utility.comparison_tests import *
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from pytriqs.utility.h5diff import h5diff
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import pytriqs.utility.mpi as mpi
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from converters import Wien2kConverter
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from triqs_dft_tools.converters import Wien2kConverter
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Converter = Wien2kConverter(filename='SrVO3')
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Converter.hdf_file = 'wien2k_convert.out.h5'
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