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--- tools:aml [2022/07/07 15:17] – created oschuett
+++ tools:aml [2022/07/07 15:18] – oschuett
@@ Line 18: / Line 18: @@
 cell = np.array([[A,0,0],[0,B,0],[0,0,C]])
-frames = aml.read_frames_cp2k(fn_positions=fn_positions, fn_forces=fn_forces, cell=cell)
+frames = aml.read_frames_cp2k(fn_positions=fn_positions,
+                              fn_forces=fn_forces,
+                              cell=cell)
 structures = aml.Structures.from_frames(frames)
 structures.to_file('input.data', label_prop='reference')
 </code>