Xe sc LJ_Shifted_Bernardes_1958MedCutoff_Xe__MO_849320763277_004 4.254335060715676
Optimization terminated successfully.
         Current function value: -0.109498
         Iterations: 72
         Function evaluations: 188

C11 =     6.280791 +/-     0.007336 GPa
C12 =    -0.390309 +/-     0.005187 GPa
C44 =    -0.460082 +/-     0.001834 GPa
B   =     1.833391 +/-     0.004235 GPa