Compress test vasprun.xml files (#3648)

* compress some test vasprun.xml * compress remaining vasprun.xml * fix file names outside vasp test dir * compress lobster vasprun (not see used anywhere) * remove unused lobster vasprun test file
materialsproject · Feb 23, 2024 · 5b5ea57 · 5b5ea57
1 parent 57842a7
commit 5b5ea57
Show file tree

Hide file tree

Showing 91 changed files with 64 additions and 4,975,904 deletions.
diff --git a/tests/analysis/test_xps.py b/tests/analysis/test_xps.py
@@ -7,7 +7,7 @@
 
 class XPSTestCase(PymatgenTest):
     def test_from_dos(self):
-        vasp_run = Vasprun(f"{TEST_FILES_DIR}/vasprun.xml.LiF")
+        vasp_run = Vasprun(f"{TEST_FILES_DIR}/vasprun.xml.LiF.gz")
         dos = vasp_run.complete_dos
         xps = XPS.from_dos(dos)
         assert len(xps) == 301

diff --git a/tests/electronic_structure/test_bandstructure.py b/tests/electronic_structure/test_bandstructure.py
@@ -256,7 +256,7 @@ def test_reconstruct_band_structure(self):
 
     def test_vasprun_bs(self):
         bsv = BSVasprun(
-            f"{TEST_FILES_DIR}/vasprun.xml",
+            f"{TEST_FILES_DIR}/vasprun.xml.gz",
             parse_projected_eigen=True,
             parse_potcar_file=True,
         )

diff --git a/tests/electronic_structure/test_plotter.py b/tests/electronic_structure/test_plotter.py
@@ -201,7 +201,7 @@ class TestBSDOSPlotter(unittest.TestCase):
     # Minimal baseline testing for get_plot. not a true test. Just checks that
     # it can actually execute.
     def test_methods(self):
-        vasp_run = Vasprun(f"{TEST_FILES_DIR}/vasprun_Si_bands.xml")
+        vasp_run = Vasprun(f"{TEST_FILES_DIR}/vasprun_Si_bands.xml.gz")
         plotter = BSDOSPlotter()
         band_struct = vasp_run.get_band_structure(kpoints_filename=f"{TEST_FILES_DIR}/KPOINTS_Si_bands")
         ax = plotter.get_plot(band_struct)

diff --git a/tests/entries/test_computed_entries.py b/tests/entries/test_computed_entries.py
@@ -24,7 +24,7 @@
 from pymatgen.io.vasp.outputs import Vasprun
 from pymatgen.util.testing import TEST_FILES_DIR
 
-filepath = f"{TEST_FILES_DIR}/vasprun.xml"
+filepath = f"{TEST_FILES_DIR}/vasprun.xml.gz"
 vasp_run = Vasprun(filepath)
 
 

diff --git a/tests/files/Li_no_projected.xml b/tests/files/Li_no_projected.xml
diff --git a/tests/files/Li_no_projected.xml.gz b/tests/files/Li_no_projected.xml.gz
diff --git a/tests/files/bad_vasprun.xml b/tests/files/bad_vasprun.xml
diff --git a/tests/files/bad_vasprun.xml.gz b/tests/files/bad_vasprun.xml.gz
diff --git a/tests/files/lifepo4.xml b/tests/files/lifepo4.xml
diff --git a/tests/files/lifepo4.xml.gz b/tests/files/lifepo4.xml.gz