Pd sc Sim_LAMMPS_ADP_XuWangQian_2022_NiPd__SM_559286646876_000 2.580729462206364 Optimization terminated successfully. Current function value: -3.350037 Iterations: 83 Function evaluations: 218 C11 = 438.953891 +/- 0.007336 GPa C12 = 25.283446 +/- 0.005187 GPa C44 = -12.838709 +/- 0.001834 GPa B = 163.173594 +/- 0.004235 GPa