bandu 1.3.1__tar.gz → 1.3.2__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.
Files changed (18) hide show
  1. {bandu-1.3.1/src/bandu.egg-info → bandu-1.3.2}/PKG-INFO +1 -1
  2. {bandu-1.3.1 → bandu-1.3.2}/pyproject.toml +1 -1
  3. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/abinit_reader.py +1 -5
  4. {bandu-1.3.1 → bandu-1.3.2/src/bandu.egg-info}/PKG-INFO +1 -1
  5. {bandu-1.3.1 → bandu-1.3.2}/LICENSE +0 -0
  6. {bandu-1.3.1 → bandu-1.3.2}/README.md +0 -0
  7. {bandu-1.3.1 → bandu-1.3.2}/setup.cfg +0 -0
  8. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/bandu.py +0 -0
  9. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/brillouin_zone.py +0 -0
  10. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/colors.py +0 -0
  11. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/isosurface_class.py +0 -0
  12. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/plotter.py +0 -0
  13. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/translate.py +0 -0
  14. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/wfk_class.py +0 -0
  15. {bandu-1.3.1 → bandu-1.3.2}/src/bandu/xsf_reader.py +0 -0
  16. {bandu-1.3.1 → bandu-1.3.2}/src/bandu.egg-info/SOURCES.txt +0 -0
  17. {bandu-1.3.1 → bandu-1.3.2}/src/bandu.egg-info/dependency_links.txt +0 -0
  18. {bandu-1.3.1 → bandu-1.3.2}/src/bandu.egg-info/top_level.txt +0 -0
{bandu-1.3.1/src/bandu.egg-info → bandu-1.3.2}/PKG-INFO RENAMED
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: bandu
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- Version: 1.3.1
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+ Version: 1.3.2
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  Summary: The BandU program constructs a rank ordered series of crystal orbitals using principal component analysis. These principal orbital components can then be projected on the Fermi surface and visualized
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  Author-email: Patrick Cross <pcross@wisc.edu>
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  Project-URL: Homepage, https://github.com/pcross0405/BandU
{bandu-1.3.1 → bandu-1.3.2}/pyproject.toml RENAMED
@@ -4,7 +4,7 @@ build-backend = "setuptools.build_meta"
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  [project]
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  name = "bandu"
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- version = "1.3.1"
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+ version = "1.3.2"
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  authors = [
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  { name="Patrick Cross", email="pcross@wisc.edu" },
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  ]
{bandu-1.3.1 → bandu-1.3.2}/src/bandu/abinit_reader.py RENAMED
@@ -963,11 +963,7 @@ class AbinitNetCDF():
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  self.nband:int = int(self.dataset.dimensions['bantot'].size / self.nkpt)
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  self.typat:list = self.dataset.variables['atom_species'][:].tolist()
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  self.zion:np.ndarray = self.dataset.variables['atomic_numbers'][:]
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- _all_ions = [int(self.zion[i-1]) for i in self.typat]
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- self.znucltypat:list = []
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- for i in _all_ions:
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- if i not in self.znucltypat:
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- self.znucltypat.append(i)
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+ self.znucltypat:list = [int(nuc) for nuc in self.zion]
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  self.bands = [self.nband]
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  #---------------------------------------------------------------------------------------------------------------------#
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  #------------------------------------------------------ METHODS ------------------------------------------------------#
{bandu-1.3.1 → bandu-1.3.2/src/bandu.egg-info}/PKG-INFO RENAMED
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: bandu
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- Version: 1.3.1
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+ Version: 1.3.2
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  Summary: The BandU program constructs a rank ordered series of crystal orbitals using principal component analysis. These principal orbital components can then be projected on the Fermi surface and visualized
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  Author-email: Patrick Cross <pcross@wisc.edu>
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  Project-URL: Homepage, https://github.com/pcross0405/BandU
{bandu-1.3.1 → bandu-1.3.2}/LICENSE RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/README.md RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/setup.cfg RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/src/bandu/bandu.py RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/src/bandu/brillouin_zone.py RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/src/bandu/colors.py RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/src/bandu/plotter.py RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/src/bandu/translate.py RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/src/bandu/wfk_class.py RENAMED
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{bandu-1.3.1 → bandu-1.3.2}/src/bandu/xsf_reader.py RENAMED
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