Elements: Si
Masses in g/mol (must match order of elements above): 28.0855
Model: SW_LeeHwang_2012GGA_Si__MO_040570764911_001
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: -3.821135 eV
Unrelaxed energy with isolated atomic energies subtracted: -3.821135 eV 


Raw relaxed total potential energy: -8.9523637 eV
Relaxed energy with isolated atomic energies subtracted: -8.9523637 eV