N sc Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000 2.570534288883209
Optimization terminated successfully.
         Current function value: -0.333645
         Iterations: 73
         Function evaluations: 193

C11 =     3.992658 +/-     0.007336 GPa
C12 =   124.016794 +/-     0.005187 GPa
C44 =    -4.597872 +/-     0.001834 GPa
B   =    84.008749 +/-     0.004235 GPa