Ca fcc Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 5.526318043470383
Optimization terminated successfully.
         Current function value: -13.537787
         Iterations: 76
         Function evaluations: 191

C11 =   167.038892 +/-     0.007336 GPa
C12 =   160.154951 +/-     0.005187 GPa
C44 =     6.570982 +/-     0.001834 GPa
B   =   162.449598 +/-     0.004235 GPa