C diamond Sim_LAMMPS_LCBOP_LosFasolino_2003_C__SM_469631949122_000 3.56523135304451 Optimization terminated successfully. Current function value: -58.805504 Iterations: 71 Function evaluations: 182 C11 = 1074.216216 +/- 0.007336 GPa C12 = 121.308377 +/- 0.005187 GPa C44 = 573.187699 +/- 0.001834 GPa B = 438.944323 +/- 0.004235 GPa