Au fcc Sim_LAMMPS_ADP_WangXuQian_2021_AuRh__SM_066295357485_000 4.080000087618828 Warning: Maximum number of iterations has been exceeded. C11 = 201.654550 +/- 0.007336 GPa C12 = 169.692559 +/- 0.005187 GPa C44 = 45.659142 +/- 0.001834 GPa B = 180.346556 +/- 0.004235 GPa