Mo sc Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Mo__MO_666830945336_002 2.654022544622421 Optimization terminated successfully. Current function value: -5.006761 Iterations: 83 Function evaluations: 225 C11 = 680.872114 +/- 0.007336 GPa C12 = -77.745200 +/- 0.005187 GPa C44 = -77.744015 +/- 0.001834 GPa B = 175.127238 +/- 0.004235 GPa