Mg diamond Sim_LAMMPS_ADP_SmirnovaStarikovVlasova_2018_MgH__SM_899925688973_000 6.790618270635606 Optimization terminated successfully. Current function value: -8.110373 Iterations: 77 Function evaluations: 207 C11 = 42.051476 +/- 0.007336 GPa C12 = 24.767271 +/- 0.005187 GPa C44 = 9.223248 +/- 0.001834 GPa B = 30.528673 +/- 0.004235 GPa