diff --git a/python/converters/vasp_converter.py b/python/converters/vasp_converter.py index fa680170..01b38a19 100644 --- a/python/converters/vasp_converter.py +++ b/python/converters/vasp_converter.py @@ -219,8 +219,8 @@ class VaspConverter(ConverterTools): hopping[ik, isp, ib, ib] = rf.next() # Projectors - print n_orbitals - print [crsh['dim'] for crsh in corr_shells] +# print n_orbitals +# print [crsh['dim'] for crsh in corr_shells] proj_mat = numpy.zeros([n_k, n_spin_blocs, n_corr_shells, max([crsh['dim'] for crsh in corr_shells]), max(n_orbitals)], numpy.complex_) # TODO: implement reading from more than one projector group @@ -250,7 +250,7 @@ class VaspConverter(ConverterTools): things_to_set = ['n_shells','shells','n_corr_shells','corr_shells','n_spin_blocs','n_orbitals','n_k','SO','SP','energy_unit'] for it in things_to_set: - print "%s:"%(it), locals()[it] +# print "%s:"%(it), locals()[it] setattr(self,it,locals()[it]) except StopIteration: @@ -608,7 +608,7 @@ class VaspConverter(ConverterTools): lattice_type = R.readline().split()[0] R.readline() temp = R.readline() - print temp +# print temp lattice_constants = numpy.array([float(temp[0+10*i:10+10*i].strip()) for i in range(3)]) lattice_angles = numpy.array([float(temp[30+10*i:40+10*i].strip()) for i in range(3)]) * numpy.pi / 180.0 things_to_save.extend(['lattice_type', 'lattice_constants', 'lattice_angles']) @@ -781,6 +781,6 @@ class VaspConverter(ConverterTools): if not (symm_subgrp in ar): ar.create_group(symm_subgrp) things_to_save = ['n_symm','n_atoms','perm','orbits','SO','SP','time_inv','mat','mat_tinv'] for it in things_to_save: - print "%s:"%(it), locals()[it] +# print "%s:"%(it), locals()[it] ar[symm_subgrp][it] = locals()[it] del ar