Add support .fcidump extension

tovrstra · Jul 9, 2024 · 73ff61a · 73ff61a
1 parent decf6eb
commit 73ff61a
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Showing 2 changed files with 2 additions and 2 deletions.
diff --git a/iodata/formats/fcidump.py b/iodata/formats/fcidump.py
@@ -40,7 +40,7 @@
 __all__ = ()
 
 
-PATTERNS = ["*FCIDUMP*"]
+PATTERNS = ["*FCIDUMP*", "*.fcidump"]
 
 
 LOAD_ONE_NOTES = """

diff --git a/iodata/test/test_fcidump.py b/iodata/test/test_fcidump.py
@@ -93,7 +93,7 @@ def test_dump_load_fcidimp_consistency_ao(tmpdir):
         mol0.two_ints = {"two_mo": np.load(str(fn))}
 
     # Dump to a file and load it again
-    fn_tmp = os.path.join(tmpdir, "FCIDUMP")
+    fn_tmp = os.path.join(tmpdir, "tmp.fcidump")
     dump_one(mol0, fn_tmp)
     mol1 = load_one(fn_tmp)