Elements: Si
Masses in g/mol (must match order of elements above): 28.0855
Model: Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_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: 4.7430738 eV
Unrelaxed energy with isolated atomic energies subtracted: 4.7430738 eV 


Raw relaxed total potential energy: -10.73678 eV
Relaxed energy with isolated atomic energies subtracted: -10.73678 eV