whitespace

This commit is contained in:
Axel Kohlmeyer
2022-09-24 15:34:41 -04:00
parent a02ab6eaa1
commit 59ca352e48
4 changed files with 12 additions and 12 deletions

View File

@ -19,16 +19,16 @@ class MLIAPUnifiedLJ(MLIAPUnified):
def compute_gradients(self, data):
"""Test compute_gradients."""
def compute_descriptors(self, data):
"""Test compute_descriptors."""
def compute_forces(self, data):
"""Test compute_forces."""
eij, fij = self.compute_pair_ef(data)
data.update_pair_energy(eij)
data.update_pair_forces(fij)
def compute_pair_ef(self, data):
rij = data.rij