Fe sc Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Fe__MO_984358344196_002 2.3887424916 Optimization terminated successfully. Current function value: -3.268262 Iterations: 72 Function evaluations: 189 C11 = 461.229365 +/- 0.007336 GPa C12 = -56.801589 +/- 0.005187 GPa C44 = -56.800450 +/- 0.001834 GPa B = 115.875396 +/- 0.004235 GPa