Elements: Si Masses in g/mol (must match order of elements above): 28.0855 Model: Sim_LAMMPS_EDIP_JiangMorganSzlufarska_2012_SiC__SM_435704953434_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: -9.7820463 eV Unrelaxed energy with isolated atomic energies subtracted: -9.7820463 eV Raw relaxed total potential energy: -12.092646 eV Relaxed energy with isolated atomic energies subtracted: -12.092646 eV