Enter a species  (e.g. Al, Fe): Au
Enter a hexagonal lattice type (e.g. hcp): hcp
Enter a model name: Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000
Enter hexagonal lattice constants 'a' and 'c' (m): 2.949497327958259e-10, 4.661917626434998e-10

Calculating isothermal bulk modulus

Warning: Maximum number of function evaluations has been exceeded.

Finished calculation

C11 = 68.40140558378106 GPa
C12 = 7.816266095992638 GPa
  B = 28.01131259192211 GPa