Es diamond LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 7.33837038279
Optimization terminated successfully.
         Current function value: -15.437305
         Iterations: 77
         Function evaluations: 198
* Error (Neighbor List) : "Cell size too large. Check if you have partilces fly away." : 103:kimpy/neighlist/neighbor_list.cpp