Mo sc Sim_LAMMPS_ADP_StarikovKolotovaKuksin_2017_UMo__SM_682749584055_000 2.543479919433594
Warning: Maximum number of iterations has been exceeded.

C11 =   285.408054 +/-     0.007336 GPa
C12 =   108.143868 +/-     0.005187 GPa
C44 =   -66.695766 +/-     0.001834 GPa
B   =   167.231930 +/-     0.004235 GPa