log.26Jun12.dpd.4
f3404420e445lammm-devel

log.26Jun12.dpd.4
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			LAMMPS (29 Jun 2012)
			# DPD benchmark

			units lj
			atom_style atomic
			communicate single vel yes

			lattice fcc 3.0
			Lattice spacing in x,y,z = 1.10064 1.10064 1.10064
			region box block 0 20 0 20 0 20
			create_box 1 box
			Created orthogonal box = (0 0 0) to (22.0128 22.0128 22.0128)
			1 by 2 by 2 MPI processor grid
			create_atoms 1 box
			Created 32000 atoms
			mass 1 1.0

			velocity all create 1.0 87287 loop geom

			pair_style dpd 1.0 1.0 928948
			pair_coeff 1 1 25.0 4.5

			neighbor 0.5 bin
			neigh_modify delay 0 every 1

			fix 1 all nve
			timestep 0.04

			run 100
			Memory usage per processor = 3.88609 Mbytes
			Step Temp E_pair E_mol TotEng Press
			0 1 3.6872574 0 5.1872105 28.911346
			100 1.0219182 4.5817845 0 6.1146139 23.803115
			Loop time of 1.10533 on 4 procs for 100 steps with 32000 atoms

			Pair time (%) = 0.521759 (47.2037)
			Neigh time (%) = 0.488133 (44.1616)
			Comm time (%) = 0.0682133 (6.17129)
			Outpt time (%) = 7.55787e-05 (0.00683763)
			Other time (%) = 0.0271527 (2.45652)

			Nlocal: 8000 ave 8014 max 7986 min
			Histogram: 1 1 0 0 0 0 0 0 1 1
			Nghost: 6744 ave 6764 max 6726 min
			Histogram: 1 0 0 1 0 1 0 0 0 1
			Neighs: 165107 ave 166433 max 163419 min
			Histogram: 1 0 1 0 0 0 0 0 0 2

			Total # of neighbors = 660428
			Ave neighs/atom = 20.6384
			Neighbor list builds = 50
			Dangerous builds = 0