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Add support .fcidump extension #370

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merged 1 commit into from
Jul 9, 2024
Merged

Add support .fcidump extension #370

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2 changes: 1 addition & 1 deletion iodata/formats/fcidump.py
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Expand Up @@ -40,7 +40,7 @@
__all__ = ()


PATTERNS = ["*FCIDUMP*"]
PATTERNS = ["*FCIDUMP*", "*.fcidump"]
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LOAD_ONE_NOTES = """
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2 changes: 1 addition & 1 deletion iodata/test/test_fcidump.py
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Expand Up @@ -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")
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dump_one(mol0, fn_tmp)
mol1 = load_one(fn_tmp)

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