Zn fcc Sim_LAMMPS_ReaxFF_RaymandVanDuinBaudin_2008_ZnOH__SM_449472104549_001 3.887473255395889 Optimization terminated successfully. Current function value: -5.377778 Iterations: 78 Function evaluations: 205 C11 = 157.361186 +/- 0.007336 GPa C12 = 78.567242 +/- 0.005187 GPa C44 = 78.775476 +/- 0.001834 GPa B = 104.831890 +/- 0.004235 GPa