Enter a species (e.g. Al, Fe): Si Enter a hexagonal lattice type (e.g. hcp): hcp Enter a model name: Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 Enter hexagonal lattice constants 'a' and 'c' (m): 2.717911579665043e-10, 4.456970813036562e-10 Calculating isothermal bulk modulus Optimization terminated successfully. Current function value: -8.374914 Iterations: 72 Function evaluations: 189 Finished calculation C11 = 217.79337451323087 GPa C12 = 156.1521441727472 GPa B = 176.6992209529084 GPa