Ne fcc LJ_Shifted_Bernardes_1958HighCutoff_Ne__MO_966254629593_003 4.22618636489
Warning: Maximum number of function evaluations has been exceeded.

C11 =     2.524552 +/-     0.007336 GPa
C12 =     1.443171 +/-     0.005187 GPa
C44 =     1.446246 +/-     0.001834 GPa
B   =     1.803632 +/-     0.004235 GPa