log.22Jun07.eam.fixed.linux.1
8922e60cf07elammps-icms

log.22Jun07.eam.fixed.linux.1
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			LAMMPS (22 June 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 orthogonal box = (0 0 0) to (72.3 72.3 72.3)
			1 by 1 by 1 processor grid
			create_atoms 1 box
			Created 32000 atoms

			pair_style eam
			pair_coeff 1 1 Cu_u3.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 = 15.2616 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 31.0146 on 1 procs for 100 steps with 32000 atoms

			Pair time (%) = 27.1822 (87.6433)
			Neigh time (%) = 2.71986 (8.76962)
			Comm time (%) = 0.338775 (1.09231)
			Outpt time (%) = 0.002124 (0.00684839)
			Other time (%) = 0.771616 (2.48791)

			Nlocal: 32000 ave 32000 max 32000 min
			Histogram: 1 0 0 0 0 0 0 0 0 0
			Nghost: 19909 ave 19909 max 19909 min
			Histogram: 1 0 0 0 0 0 0 0 0 0
			Neighs: 1.20989e+06 ave 1.20989e+06 max 1.20989e+06 min
			Histogram: 1 0 0 0 0 0 0 0 0 0

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