diff --git a/doc/Ce-gamma.py b/doc/Ce-gamma.py index 104753a7..5cee006b 100644 --- a/doc/Ce-gamma.py +++ b/doc/Ce-gamma.py @@ -21,7 +21,7 @@ use_val= U_int * (Natomic - 0.5) - J_hund * (Natomic * 0.5 - 0.5) # Convert DMFT input: # Can be commented after the first run Converter = Wien2kConverter(filename=dft_filename) -Converter.convert_dmft_input() +Converter.convert_dft_input() #check if there are previous runs: previous_runs = 0 diff --git a/doc/Ce-gamma_DOS.py b/doc/Ce-gamma_DOS.py index b2975361..2caf6a34 100644 --- a/doc/Ce-gamma_DOS.py +++ b/doc/Ce-gamma_DOS.py @@ -22,7 +22,7 @@ HDFfilename = dft_filename+'.h5' # Convert DMFT input: # Can be commented after the first run Converter = Wien2kConverter(filename=dft_filename,repacking=True) -Converter.convert_dmft_input() +Converter.convert_dft_input() Converter.convert_parproj_input() #check if there are previous runs: diff --git a/doc/advanced.rst b/doc/advanced.rst index 475bef98..a9022346 100644 --- a/doc/advanced.rst +++ b/doc/advanced.rst @@ -36,7 +36,7 @@ Most of these parameters are self-explaining. The first, `dft_filename`, gives t The next step, as described in the previous section, is to convert the input files:: Converter = Wien2kConverter(filename=dft_filename, repacking=True) - Converter.convert_dmft_input() + Converter.convert_dft_input() mpi.barrier() The command ``mpi.barrier()`` ensures that all nodes wait until the conversion of the input is finished on the master diff --git a/doc/interface.rst b/doc/interface.rst index 58434bb2..e1dae17a 100644 --- a/doc/interface.rst +++ b/doc/interface.rst @@ -46,7 +46,7 @@ There are three optional parameters to the Constructor: After initialising the interface module, we can now convert the input text files into the hdf5 arxive by:: - Converter.convert_dmft_input() + Converter.convert_dft_input() This reads all the data, and stores it in the subgroup `dft_subgrp`, as discussed above. In this step, the files :file:`material_of_interest.ctqmcout` and :file:`material_of_interest.symqmc` diff --git a/lda_dmft_cthyb.py b/lda_dmft_cthyb.py index d332ac0d..28f321b7 100644 --- a/lda_dmft_cthyb.py +++ b/lda_dmft_cthyb.py @@ -27,7 +27,7 @@ p["n_warmup_cycles"] = 50 p["n_cycles"] = 5000 Converter = Wien2kConverter(filename=dft_filename, repacking=True) -Converter.convert_dmft_input() +Converter.convert_dft_input() mpi.barrier() previous_runs = 0 diff --git a/python/converters/hk_converter.py b/python/converters/hk_converter.py index 14ad5f8e..26269993 100644 --- a/python/converters/hk_converter.py +++ b/python/converters/hk_converter.py @@ -50,7 +50,7 @@ class HkConverter(ConverterTools): ConverterTools.repack(self) - def convert_dmft_input(self, first_real_part_matrix = True, only_upper_triangle = False, weights_in_file = False): + def convert_dft_input(self, first_real_part_matrix = True, only_upper_triangle = False, weights_in_file = False): """ Reads the input files, and stores the data in the HDFfile """ diff --git a/python/converters/wien2k_converter.py b/python/converters/wien2k_converter.py index 6bd1d7bf..1ed26a5c 100644 --- a/python/converters/wien2k_converter.py +++ b/python/converters/wien2k_converter.py @@ -59,7 +59,7 @@ class Wien2kConverter(ConverterTools): ConverterTools.repack(self) - def convert_dmft_input(self): + def convert_dft_input(self): """ Reads the input files, and stores the data in the HDFfile """ diff --git a/python/trans_basis.py b/python/trans_basis.py index e483ea11..12aa6f5b 100644 --- a/python/trans_basis.py +++ b/python/trans_basis.py @@ -20,7 +20,7 @@ class TransBasis: return 0 Converter = Wien2kConverter(filename=hdf_datafile,repacking=False) - Converter.convert_dmft_input() + Converter.convert_dft_input() del Converter self.SK = SumkDFT(hdf_file=hdf_datafile+'.h5',use_dft_blocks=False) diff --git a/test/hk_convert.py b/test/hk_convert.py index 171501d5..a50f2a6c 100644 --- a/test/hk_convert.py +++ b/test/hk_convert.py @@ -26,4 +26,4 @@ from pytriqs.archive import * Converter = HkConverter(hk_filename='hk_convert_hamiltonian.hk',hdf_filename='hk_convert.output.h5') -Converter.convert_dmft_input() +Converter.convert_dft_input() diff --git a/test/wien2k_convert.py b/test/wien2k_convert.py index 12922a78..13b01c7a 100644 --- a/test/wien2k_convert.py +++ b/test/wien2k_convert.py @@ -26,7 +26,7 @@ from pytriqs.applications.dft.converters import Wien2kConverter Converter = Wien2kConverter(filename='SrVO3') Converter.hdf_file = 'wien2k_convert.output.h5' -Converter.convert_dmft_input() +Converter.convert_dft_input() Converter.convert_parproj_input()