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: 45.190506 eV
Unrelaxed energy with isolated atomic energies subtracted: 45.190506 eV 


Raw relaxed total potential energy: -7.0960126 eV
Relaxed energy with isolated atomic energies subtracted: -7.0960126 eV