Zr bcc Sim_LAMMPS_ADP_SmirnovaStarikov_2017_ZrNb__SM_937902197407_000 3.56816098839
Warning: Maximum number of function evaluations has been exceeded.

C11 =   102.528105 +/-     0.007336 GPa
C12 =    64.555296 +/-     0.005187 GPa
C44 =    37.615755 +/-     0.001834 GPa
B   =    77.212899 +/-     0.004235 GPa