Elements: Si Masses in g/mol (must match order of elements above): 28.0855 Model: Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 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: -14.540208 eV Unrelaxed energy with isolated atomic energies subtracted: -14.540208 eV Raw relaxed total potential energy: -17.735789 eV Relaxed energy with isolated atomic energies subtracted: -17.735789 eV