Mo diamond SW_MX2_KurniawanPetrieWilliams_2021_MoS__MO_677328661525_000 4.585475042462349
Optimization terminated successfully.
         Current function value: -57.625853
         Iterations: 72
         Function evaluations: 186

C11 = -16371406.448377 +/-     0.007336 GPa
C12 =   311.952789 +/-     0.005187 GPa
C44 = -6139357.788265 +/-     0.001834 GPa
B   = -5456927.514266 +/-     0.004235 GPa