Fe sc Sim_LAMMPS_TersoffZBL_HenrikssonBjorkasNordlund_2013_FeC__SM_473463498269_000 2.4528512880206113 Warning: Maximum number of iterations has been exceeded. C11 = 267.475768 +/- 0.007336 GPa C12 = 0.000000 +/- 0.005187 GPa C44 = -15.097452 +/- 0.001834 GPa B = 89.158589 +/- 0.004235 GPa