Elements: Si Masses in g/mol (must match order of elements above): 28.0855 Model: Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_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: 18.223954 eV Unrelaxed energy with isolated atomic energies subtracted: 18.223954 eV Raw relaxed total potential energy: 2.220446e-16 eV Relaxed energy with isolated atomic energies subtracted: 2.220446e-16 eV