Al bcc Tersoff_LAMMPS_PlummerRathodSrivastava_2021_TiAlC__MO_992900971352_000 3.228682197630405 Optimization terminated successfully. Current function value: -6.533243 Iterations: 71 Function evaluations: 189 C11 = 87.389970 +/- 0.007336 GPa C12 = 75.942268 +/- 0.005187 GPa C44 = 43.173139 +/- 0.001834 GPa B = 79.758168 +/- 0.004235 GPa