Se bcc Sim_LAMMPS_BOP_ZhouFosterVanSwol_2014_CdTeSe__SM_567065323363_000 3.66631294787
Warning: Maximum number of function evaluations has been exceeded.

C11 =    80.535012 +/-     0.007336 GPa
C12 =   104.815659 +/-     0.005187 GPa
C44 =     5.736619 +/-     0.001834 GPa
B   =    96.722110 +/-     0.004235 GPa