Kr diamond LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 5.159101784229279
Warning: Maximum number of iterations has been exceeded.

C11 =     3.354605 +/-     0.007336 GPa
C12 =     4.491568 +/-     0.005187 GPa
C44 =    -1.287649 +/-     0.001834 GPa
B   =     4.112580 +/-     0.004235 GPa