Mn bcc LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 3.059910222887993 Optimization terminated successfully. Current function value: -9.550139 Iterations: 72 Function evaluations: 190 C11 = 378.845251 +/- 0.007336 GPa C12 = 462.551085 +/- 0.005187 GPa C44 = 463.061117 +/- 0.001834 GPa B = 434.649140 +/- 0.004235 GPa