Enter a species (e.g. Al, Fe): Si Enter a hexagonal lattice type (e.g. hcp): hcp Enter a model name: ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 Enter hexagonal lattice constants 'a' and 'c' (m): 2.788106913971087e-10, 4.358895538071596e-10 Calculating isothermal bulk modulus Optimization terminated successfully. Current function value: -13.293477 Iterations: 72 Function evaluations: 191 Finished calculation C11 = 935.6489892839833 GPa C12 = 464.0030663837137 GPa B = 621.2183740171369 GPa