Zr diamond Sim_LAMMPS_ADP_StarikovSmirnova_2021_ZrNb__SM_993852507257_000 5.863710626959802
Optimization terminated successfully.
         Current function value: -39.882096
         Iterations: 71
         Function evaluations: 188

C11 = -2714069.089251 +/-     0.007336 GPa
C12 =   130.421196 +/-     0.005187 GPa
C44 = -1017812.056876 +/-     0.001834 GPa
B   = -904602.748953 +/-     0.004235 GPa