O fcc Sim_LAMMPS_ReaxFF_RaymandVanDuinBaudin_2008_ZnOH__SM_449472104549_001 2.869511485099793 Optimization terminated successfully. Current function value: 4.788032 Iterations: 73 Function evaluations: 198 C11 = 51450.100760 +/- 0.007336 GPa C12 = 50768.614478 +/- 0.005187 GPa C44 = 1305.154694 +/- 0.001834 GPa B = 50995.776572 +/- 0.004235 GPa