pair correlation ################ si-si ----- 2.96: saves/c_in_si_prec_450_01/s-0004000.save 67101 8.0 5.429 186262 c-c --- 3.1: saves/c_in_si_prec_450_01/s-0566000.save 239458 240660 110 - 100 239703 241605 100 - 100 concatenated, differently oriented 100 dumbbells ################################################ posic_new/saves/c_in_si_prec_450_tot_02/s-0272000.save b 3.08 0.01 atoms 238338/1 238631/1 - 3.078045 atoms 238461/1 244278/1 - 3.085715