Enter a species (e.g. Al, Fe): Fe Enter a hexagonal lattice type (e.g. hcp): hcp Enter a model name: Sim_LAMMPS_EAMCD_StukowskiSadighErhart_2009_FeCr__SM_775564499513_000 Enter hexagonal lattice constants 'a' and 'c' (m): 2.620636874003441e-10, 4.145277845420277e-10 Calculating isothermal bulk modulus Optimization terminated successfully. Current function value: -8.009856 Iterations: 69 Function evaluations: 181 Finished calculation C11 = 89.18875609551996 GPa C12 = 57.72267017198698 GPa B = 68.2113654798313 GPa