Ar diamond LJ_Shifted_Bernardes_1958MedCutoff_Ar__MO_126566794224_003 8.486637339
Warning: Maximum number of function evaluations has been exceeded.

C11 =     0.452326 +/-     0.007336 GPa
C12 =     0.605631 +/-     0.005187 GPa
C44 =    -0.173609 +/-     0.001834 GPa
B   =     0.554529 +/-     0.004235 GPa