Kr sc LJ_Shifted_Bernardes_1958HighCutoff_Kr__MO_923895531627_003 3.89682707936
Warning: Maximum number of function evaluations has been exceeded.

C11 =     5.882164 +/-     0.007336 GPa
C12 =    -0.367761 +/-     0.005187 GPa
C44 =    -0.367759 +/-     0.001834 GPa
B   =     1.715547 +/-     0.004235 GPa