Zr bcc Sim_LAMMPS_ADP_SmirnovaStarikov_2017_ZrNb__SM_937902197407_000 3.5681609660387044
Warning: Maximum number of iterations has been exceeded.

C11 =   102.528059 +/-     0.007336 GPa
C12 =    64.555237 +/-     0.005187 GPa
C44 =    37.615759 +/-     0.001834 GPa
B   =    77.212844 +/-     0.004235 GPa