Re fcc LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 4.153284206986426 Optimization terminated successfully. Current function value: -147.807505 Iterations: 75 Function evaluations: 190 C11 = 3774.788936 +/- 0.007336 GPa C12 = 2153.683234 +/- 0.005187 GPa C44 = 2158.159583 +/- 0.001834 GPa B = 2694.051801 +/- 0.004235 GPa