Si fcc Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 3.84958603978157 Optimization terminated successfully. Current function value: -16.730705 Iterations: 70 Function evaluations: 185 C11 = 173.522950 +/- 0.007336 GPa C12 = 177.888173 +/- 0.005187 GPa C44 = 34.404353 +/- 0.001834 GPa B = 176.433098 +/- 0.004235 GPa