Mo bcc SW_MX2_KurniawanPetrieWilliams_2021_MoS__MO_677328661525_000 2.459976688027382 Optimization terminated successfully. Current function value: -25.357701 Iterations: 74 Function evaluations: 196 C11 = 847.584186 +/- 0.007336 GPa C12 = 685.100609 +/- 0.005187 GPa C44 = 689.335243 +/- 0.001834 GPa B = 739.261801 +/- 0.004235 GPa