Elements: Si Masses in g/mol (must match order of elements above): 28.0855 Model: Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 XYZ file: cluster.xyz Isolated atomic energy for species Si: 0.0 eV Sum of isolated atomic energies: 0.0 eV Raw unrelaxed total potential energy: -3.7991621 eV Unrelaxed energy with isolated atomic energies subtracted: -3.7991621 eV Raw relaxed total potential energy: -5.9476841 eV Relaxed energy with isolated atomic energies subtracted: -5.9476841 eV