Si bcc Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 3.2879641577601433 Optimization terminated successfully. Current function value: -7.386550 Iterations: 74 Function evaluations: 195 C11 = 546.609600 +/- 0.007336 GPa C12 = 489.200499 +/- 0.005187 GPa C44 = -16.096399 +/- 0.001834 GPa B = 508.336866 +/- 0.004235 GPa