Fe diamond Sim_LAMMPS_EAM_BonnyCastinBullens_2013_FeCrW__SM_699257350704_000 5.41373476386 Warning: Maximum number of function evaluations has been exceeded. C11 = 41.074455 +/- 0.007336 GPa C12 = 51.564655 +/- 0.005187 GPa C44 = -408169.419026 +/- 0.001834 GPa B = 48.067921 +/- 0.004235 GPa