Cr diamond Sim_LAMMPS_EAM_BonnyPasianotTerentyev_2011_FeCr__SM_237089298463_000 5.82243442535 Optimization terminated successfully. Current function value: -16.585766 Iterations: 72 Function evaluations: 188 C11 = 21.095666 +/- 0.007336 GPa C12 = 21.095292 +/- 0.005187 GPa C44 = -0.114271 +/- 0.001834 GPa B = 21.095417 +/- 0.004235 GPa