SAMBA-ilum 1.0.0.505__tar.gz → 1.0.0.506__tar.gz
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/PKG-INFO +1 -1
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/SAMBA_ilum.egg-info/PKG-INFO +1 -1
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/__main__.py +1 -1
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/make_files.py +11 -8
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/setup.py +1 -1
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/LICENSE.txt +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/README.md +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/SAMBA_ilum.egg-info/SOURCES.txt +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/SAMBA_ilum.egg-info/dependency_links.txt +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/SAMBA_ilum.egg-info/entry_points.txt +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/SAMBA_ilum.egg-info/requires.txt +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/SAMBA_ilum.egg-info/top_level.txt +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/__init__.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/BZ_2D.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/HeteroStructure_Generator.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_a-scan +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_bader +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_bader.SO +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_bands +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_bands.SO +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_dos +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_dos.SO +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_relax +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_scf +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_scf.SO +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_xy-scan +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_xyz-scan +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/INCAR_z-scan +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/SAMBA_HeteroStructure.input +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/SAMBA_WorkFlow.input +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/inputs_VASProcar/input.vasprocar.bands +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/inputs_VASProcar/input.vasprocar.chgcar +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/inputs_VASProcar/input.vasprocar.dos +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/inputs_VASProcar/input.vasprocar.location +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/inputs_VASProcar/input.vasprocar.locpot +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/inputs_VASProcar/input.vasprocar.orbitals +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/inputs_VASProcar/input.vasprocar.spin +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/vdw_kernel.bindat +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/_info_pseudo.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/a-scan.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/a-scan_analysis.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/bader +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/bader_poscar.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/bader_update.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/cell_check.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/charge_transfer.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/chgsum.pl +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/contcar_update.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/data-base_json.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/data-base_union.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/energy_scan.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/hubbard_correction.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/job.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/kpoints.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/lattice_plot3d.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/output.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/potcar.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/vdW_DF.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/xy-scan.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/xy-scan_analysis.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/xyz-scan.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/xyz-scan_analysis.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/z-scan.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/z-scan_analysis.py +0 -0
- {samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/setup.cfg +0 -0
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@@ -7,6 +7,7 @@ from pymatgen.analysis.structure_matcher import StructureMatcher
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import random
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import shutil
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import glob
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import uuid
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import sys
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import os
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#----------------------------------------------------------------------------
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# Função para
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# Função para excluir arquivos ocultos --------------------------------------
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def
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def delete_hidden_files(target_directory):
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search_files = os.path.join(target_directory, '.*')
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for item in glob.glob(search_files):
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try:
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if os.path.isfile(item): os.remove(item)
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except OSError: pass
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#----------------------------------------------------------------------------
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# Função para listar todas os arquivos dentro de um dado diretório ----------
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print("-------------------------------------------------------------------------")
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#-----------------------------------------------------
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structures_dir = os.path.join(dir_files, 'Structures')
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delete_hidden_files(structures_dir)
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#----------------------------------
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files = list_files(dir_files + '/Structures')
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{samba_ilum-1.0.0.505 → samba_ilum-1.0.0.506}/samba_ilum/src/INPUTS/SAMBA_HeteroStructure.input
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