Si fcc Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 3.2091024518013 Optimization terminated successfully. Current function value: -22.150875 Iterations: 71 Function evaluations: 185 C11 = 729.988053 +/- 0.007336 GPa C12 = 546.724052 +/- 0.005187 GPa C44 = 547.673860 +/- 0.001834 GPa B = 607.812052 +/- 0.004235 GPa