If additional defects are specified via the n_defects option, the magnetic moment gets always set to 0.
If the defect is, however, not a vacancy this is wrong and should be changed.
Further, if a vacancy is set by reading in an image file with a (0,0,0) vector the magnetic moment is not correctly set to 0.
If additional defects are specified via the
n_defectsoption, the magnetic moment gets always set to0. If the defect is, however, not a vacancy this is wrong and should be changed.Further, if a vacancy is set by reading in an image file with a (0,0,0) vector the magnetic moment is not correctly set to 0.