LAMMPS (9 Jan 2009) # Test of MEAM potential for SiC system units metal boundary p p p atom_style atomic read_data data.meam orthogonal box = (-6 -6 -6) to (5.97232 5.97232 5.97232) 1 by 2 by 2 processor grid 128 atoms pair_style meam pair_coeff * * library.meam Si C SiC.meam Si C neighbor 0.3 bin neigh_modify delay 10 fix 1 all nve thermo 10 timestep 0.001 dump 1 all atom 10 dump.meam run 100 Memory usage per processor = 4.51984 Mbytes Step Temp E_pair E_mol TotEng Press 0 0 -636.93784 0 -636.93784 -76401.859 10 1777.5718 -666.27518 0 -637.0945 -150596.32 20 1908.6646 -668.42203 0 -637.08932 -120846.06 30 1937.3373 -668.90047 0 -637.09706 -101367.81 40 2110.906 -671.75978 0 -637.10706 -110475.14 50 2057.8682 -670.89589 0 -637.11385 -107817.44 60 1887.9614 -668.08977 0 -637.09693 -108906.46 70 2036.4427 -670.53667 0 -637.10635 -113836.91 80 2111.2748 -671.75001 0 -637.09124 -100964.78 90 2087.3167 -671.34241 0 -637.07694 -95316.087 100 1990.2171 -669.74712 0 -637.07564 -97755.737 Loop time of 0.151693 on 4 procs for 100 steps with 128 atoms Pair time (%) = 0.101719 (67.0561) Neigh time (%) = 0.00101835 (0.671322) Comm time (%) = 0.03768 (24.8397) Outpt time (%) = 0.00980991 (6.46697) Other time (%) = 0.0014652 (0.965902) Nlocal: 32 ave 35 max 29 min Histogram: 1 0 0 1 0 0 1 0 0 1 Nghost: 292.25 ave 307 max 279 min Histogram: 1 0 1 0 0 0 1 0 0 1 Neighs: 384.25 ave 432 max 327 min Histogram: 1 0 0 0 1 0 0 1 0 1 FullNghs: 768.5 ave 859 max 657 min Histogram: 1 0 0 1 0 0 0 0 1 1 Total # of neighbors = 3074 Ave neighs/atom = 24.0156 Neighbor list builds = 10 Dangerous builds = 10