Zr diamond Sim_LAMMPS_ADP_SmirnovaStarikov_2017_ZrNb__SM_937902197407_000 5.972456067800522
Optimization terminated successfully.
         Current function value: -39.688534
         Iterations: 79
         Function evaluations: 214

C11 = -2652204.036293 +/-     0.007336 GPa
C12 =    69.715604 +/-     0.005187 GPa
C44 = -994603.518774 +/-     0.001834 GPa
B   = -884021.535028 +/-     0.004235 GPa