H fcc Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 2.4283656924963 Optimization terminated successfully. Current function value: -0.029789 Iterations: 72 Function evaluations: 187 C11 = 516.758854 +/- 0.007336 GPa C12 = 723.383946 +/- 0.005187 GPa C44 = -216.684586 +/- 0.001834 GPa B = 654.508915 +/- 0.004235 GPa