log.12Feb07.eam.lmp.fixed.liberty.8
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log.12Feb07.eam.lmp.fixed.liberty.8
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			LAMMPS (12 Feb 2007)
			# bulk Cu lattice

			variable x index 20
			variable y index 20
			variable z index 20

			units metal
			atom_style atomic

			lattice fcc 3.615
			Lattice spacing in x,y,z = 3.615 3.615 3.615
			region box block 0 $x 0 $y 0 $z
			region box block 0 20 0 $y 0 $z
			region box block 0 20 0 20 0 $z
			region box block 0 20 0 20 0 20
			create_box 1 box
			Created box = (0 0 0) to (72.3 72.3 72.3)
			2 by 2 by 2 processor grid
			create_atoms 1
			Created 32000 atoms

			pair_style eam
			pair_coeff 1 1 cuu3.eam

			velocity all create 1600.0 376847 loop geom

			neighbor 1.0 bin
			neigh_modify every 1 delay 5 check yes

			fix 1 all nve

			timestep 0.005
			thermo 50

			run 100
			Memory usage per processor = 2.51765 Mbytes
			Step Temp E_pair E_mol TotEng Press
			0 1600 -113280 0 -106662.09 18703.573
			50 781.37184 -109870.67 0 -106638.76 52616.84
			100 792.19277 -109916.21 0 -106639.54 51739.67
			Loop time of 2.74317 on 8 procs for 100 steps with 32000 atoms

			Pair time (%) = 2.15412 (78.5268)
			Neigh time (%) = 0.18556 (6.76443)
			Comm time (%) = 0.321706 (11.7275)
			Outpt time (%) = 0.00110888 (0.0404235)
			Other time (%) = 0.0806725 (2.94085)

			Nlocal: 4000 ave 4026 max 3981 min
			Histogram: 1 1 0 2 1 2 0 0 0 1
			Nghost: 5840.62 ave 5860 max 5815 min
			Histogram: 1 0 0 0 3 0 2 0 1 1
			Neighs: 151237 ave 152083 max 150648 min
			Histogram: 2 1 0 0 3 1 0 0 0 1

			Total # of neighbors = 1209894
			Ave neighs/atom = 37.8092
			Neighbor list builds = 13
			Dangerous builds = 0