Ni bcc Sim_LAMMPS_ADP_XuWangQian_2022_NiPd__SM_559286646876_000 2.8045253977179527 Optimization terminated successfully. Current function value: -8.762716 Iterations: 71 Function evaluations: 186 C11 = 149.696006 +/- 0.007336 GPa C12 = 147.303347 +/- 0.005187 GPa C44 = 133.265518 +/- 0.001834 GPa B = 148.100900 +/- 0.004235 GPa