Ni sc Sim_LAMMPS_ADP_XuWangQian_2022_NiPd__SM_559286646876_000 2.333840288221836 Optimization terminated successfully. Current function value: -3.877221 Iterations: 1064 Function evaluations: 3164 C11 = 441.309329 +/- 0.007336 GPa C12 = 4.330936 +/- 0.005187 GPa C44 = -27.419804 +/- 0.001834 GPa B = 149.990400 +/- 0.004235 GPa