Enter a species (e.g. Al, Fe): Ca Enter a hexagonal lattice type (e.g. hcp): hcp Enter a model name: LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 Enter hexagonal lattice constants 'a' and 'c' (m): 3.423418535382535e-10, 5.590530545550643e-10 Calculating isothermal bulk modulus Optimization terminated successfully. Current function value: -2.209657 Iterations: 72 Function evaluations: 189 Finished calculation C11 = 99.20976540513902 GPa C12 = 26.551767833510613 GPa B = 50.77110035738674 GPa