Ar diamond LJ_Shifted_Bernardes_1958HighCutoff_Ar__MO_242741380554_004 8.47745281457901 Optimization terminated successfully. Current function value: -0.266078 Iterations: 1064 Function evaluations: 3165 C11 = 0.457108 +/- 0.007336 GPa C12 = 0.616862 +/- 0.005187 GPa C44 = -0.183604 +/- 0.001834 GPa B = 0.563611 +/- 0.004235 GPa