log.22Jun07.lj.fixed.liberty.8
8922e60cf07erunner

log.22Jun07.lj.fixed.liberty.8
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			LAMMPS (22 June 2007)
			# 3d Lennard-Jones melt

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

			units lj
			atom_style atomic

			lattice fcc 0.8442
			Lattice spacing in x,y,z = 1.6796 1.6796 1.6796
			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 (33.5919 33.5919 33.5919)
			2 by 2 by 2 processor grid
			create_atoms 1 box
			Created 32000 atoms
			mass 1 1.0

			velocity all create 1.44 87287 loop geom

			pair_style lj/cut 2.5
			pair_coeff 1 1 1.0 1.0 2.5

			neighbor 0.3 bin
			neigh_modify delay 0 every 20 check no

			fix 1 all nve

			run 100
			Memory usage per processor = 2.13618 Mbytes
			Step Temp E_pair E_mol TotEng Press
			0 1.44 -6.7733681 0 -4.6134356 -5.0197073
			100 0.77196819 -5.7795465 0 -4.6216304 0.079908069
			Loop time of 1.25475 on 8 procs for 100 steps with 32000 atoms

			Pair time (%) = 0.816538 (65.0759)
			Neigh time (%) = 0.0738717 (5.88738)
			Comm time (%) = 0.30246 (24.1053)
			Outpt time (%) = 0.000414073 (0.0330006)
			Other time (%) = 0.061462 (4.89836)

			Nlocal: 4000 ave 4038 max 3962 min
			Histogram: 2 1 0 1 0 0 2 0 0 2
			Nghost: 5778.12 ave 5820 max 5742 min
			Histogram: 2 0 2 0 0 1 0 2 0 1
			Neighs: 150441 ave 152219 max 147904 min
			Histogram: 1 0 0 2 0 1 0 2 0 2

			Total # of neighbors = 1203529
			Ave neighs/atom = 37.6103
			Neighbor list builds = 5
			Dangerous builds = 0