Loop time of 19647.2 on 40 procs for 4000000 steps with 2471 atoms Performance: 8.795 ns/day, 2.729 hours/ns, 203.592 timesteps/s, 503.075 katom-step/s 84.1% CPU use with 40 MPI tasks x 1 OpenMP threads MPI task timing breakdown: Section | min time | avg time | max time |%varavg| %total --------------------------------------------------------------- Pair | 5519.5 | 7228.2 | 8431 |1032.2 | 36.79 Bond | 157.84 | 257.15 | 318.28 | 316.4 | 1.31 Kspace | 3376.1 | 4330.6 | 6637.6 |1194.7 | 22.04 Neigh | 161.28 | 169.08 | 183.42 | 40.9 | 0.86 Comm | 4119.3 | 5068.3 | 5831.3 | 693.5 | 25.80 Output | 8.2254 | 8.6738 | 9.1294 | 8.2 | 0.04 Modify | 2247.7 | 2376.8 | 2512.9 | 254.4 | 12.10 Other | | 208.4 | | | 1.06 Nlocal: 61.775 ave 78 max 48 min Histogram: 4 5 2 5 5 5 5 5 1 3 Nghost: 8764.27 ave 8882 max 8674 min Histogram: 6 2 7 1 9 5 4 2 1 3 Neighs: 0 ave 0 max 0 min Histogram: 40 0 0 0 0 0 0 0 0 0 Total # of neighbors = 0 Ave neighs/atom = 0 Ave special neighs/atom = 6.7988669 Neighbor list builds = 35748 Dangerous builds = 0 variable gamma_avg equal f_phys_ave[3] print "Final averaged interfacial tension: $(v_gamma_avg:%.4f) mJ/m^2" Final averaged interfacial tension: -550.6506 mJ/m^2 unfix pz_prof unfix phys_ave unfix nvt_prod unfix momentum_prod unfix shake_OH unfix interface_track undump prod_dump uncompute chunks