Enter a species (e.g. Al, Fe): Fe Enter a hexagonal lattice type (e.g. hcp): hcp Enter a model name: Sim_LAMMPS_EAM_BonnyCastinBullens_2013_FeCrW__SM_699257350704_000 Enter hexagonal lattice constants 'a' and 'c' (m): 2.620636470621102e-10, 4.14528039667308e-10 Calculating isothermal bulk modulus Optimization terminated successfully. Current function value: -8.009854 Iterations: 69 Function evaluations: 183 Finished calculation C11 = 89.18755800737274 GPa C12 = 57.72241942560036 GPa B = 68.21079895285781 GPa