Ar fcc LJ_Smoothed_Bernardes_1958_Ar__MO_764178710049_001 5.29216037691 Optimization terminated successfully. Current function value: -0.283031 Iterations: 71 Function evaluations: 185 C11 = 3.716031 +/- 0.007336 GPa C12 = 2.135846 +/- 0.005187 GPa C44 = 2.139243 +/- 0.001834 GPa B = 2.662575 +/- 0.004235 GPa