K diamond LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 9.02840928733
Optimization terminated successfully.
         Current function value: -13.715956
         Iterations: 75
         Function evaluations: 193
* Error (Neighbor List) : "Cell size too large. Check if you have partilces fly away." : 103:kimpy/neighlist/neighbor_list.cpp