Ti bcc Tersoff_LAMMPS_PlummerTucker_2019_TiAlC__MO_736419017411_000 3.276087455451488 Optimization terminated successfully. Current function value: -9.571781 Iterations: 69 Function evaluations: 183 C11 = 174.245646 +/- 0.007336 GPa C12 = 107.101700 +/- 0.005187 GPa C44 = 63.013387 +/- 0.001834 GPa B = 129.483015 +/- 0.004235 GPa