As bcc Sim_LAMMPS_BOP_MurdickZhouWadley_2006_GaAs__SM_104202807866_000 3.225123628973961 Optimization terminated successfully. Current function value: -5.072280 Iterations: 74 Function evaluations: 195 C11 = 82.660803 +/- 0.007336 GPa C12 = 210.179368 +/- 0.005187 GPa C44 = 29.988721 +/- 0.001834 GPa B = 167.673180 +/- 0.004235 GPa