He diamond Sim_LAMMPS_Hybrid_DuanXieGuo_2019__SM_016305073020_000 5.917244493961334 Optimization terminated successfully. Current function value: -41.875096 Iterations: 72 Function evaluations: 188 C11 = -3522074.741120 +/- 0.007336 GPa C12 = 73.490696 +/- 0.005187 GPa C44 = -1320783.882598 +/- 0.001834 GPa B = -1173975.919910 +/- 0.004235 GPa