diff --git a/source/tests/pt/model/test_polarizability_fitting.py b/source/tests/pt/model/test_polarizability_fitting.py index a061780f45..84d6bd91ab 100644 --- a/source/tests/pt/model/test_polarizability_fitting.py +++ b/source/tests/pt/model/test_polarizability_fitting.py @@ -269,12 +269,7 @@ def test_permu(self): def test_trans(self): atype = self.atype.reshape(1, 5) - coord_s = torch.matmul( - torch.remainder( - torch.matmul(self.coord + self.shift, torch.linalg.inv(self.cell)), 1.0 - ), - self.cell, - ) + coord_s = self.coord + self.shift for fit_diag, scale in itertools.product([True, False], [None, self.scale]): ft0 = PolarFittingNet( self.nt,