Ni diamond Sim_LAMMPS_ADP_XuWangQian_2022_NiPd__SM_559286646876_000 5.251628518104553
Warning: Maximum number of iterations has been exceeded.

C11 = -772712.918754 +/-     0.007336 GPa
C12 =    80.983860 +/-     0.005187 GPa
C44 = -579556.628972 +/-     0.001834 GPa
B   = -257516.983678 +/-     0.004235 GPa