andrew-pike-th

Hi, thanks for the quick reply. The exact command is "casm update". I did not use a settings file. The properties.calc.json is pasted below: { "atom_coords": [ [0.0, 0.0, 0.0]...

I have found that the issue is the empty value for the force in the properties.calc.json. I manually changed it to "value": [[0,0,0]] for both configurations in SCEL1_1_1_1_0_0_0 and could...