N diamond Sim_LAMMPS_ExTeP_LosKroesAlbe_2017_BN__SM_692329995993_000 3.774758614599705
Optimization terminated successfully.
         Current function value: -35.949248
         Iterations: 68
         Function evaluations: 182

C11 =   450.720405 +/-     0.007336 GPa
C12 =   129.084077 +/-     0.005187 GPa
C44 =   228.502900 +/-     0.001834 GPa
B   =   236.296186 +/-     0.004235 GPa