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fix false argument in test
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SamTov committed Jan 31, 2022
1 parent fb8ee66 commit f73025f
Showing 1 changed file with 2 additions and 2 deletions.
Original file line number Diff line number Diff line change
Expand Up @@ -233,14 +233,14 @@ def test_ionic_liquid(self, mdsuite_project):
species_dict={"C": 8, "N": 2, "H": 15},
amount=50,
cutoff=1.9,
reference_configuration=100,
reference_configuration_idx=100,
)
bf_molecule = mdsuite.Molecule(
name="bf4",
smiles="[B-](F)(F)(F)F",
amount=50,
cutoff=2.4,
reference_configuration=100,
reference_configuration_idx=100,
)
mdsuite_project.experiments["bmim_bf4"].run.MolecularMap(
molecules=[bmim_molecule, bf_molecule]
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