LAMMPS (29 Jun 2012)
# bulk Si via Stillinger-Weber

units		metal
atom_style	atomic

lattice		diamond 5.431
Lattice spacing in x,y,z = 5.431 5.431 5.431
region		box block 0 20 0 20 0 10
create_box	1 box
Created orthogonal box = (0 0 0) to (108.62 108.62 54.31)
  2 by 2 by 1 MPI processor grid
create_atoms	1 box
Created 32000 atoms

pair_style	sw
pair_coeff	* * Si.sw Si
mass            1 28.06

velocity	all create 1000.0 376847 loop geom

neighbor	1.0 bin
neigh_modify    delay 5 every 1

fix		1 all nve

timestep	0.001

run		100
Memory usage per processor = 4.12361 Mbytes
Step Temp E_pair E_mol TotEng Press 
       0         1000    -138771.2            0      -134635    6866.6499 
     100    508.80533   -136736.12            0    -134631.6    6361.7858 
Loop time of 2.74532 on 4 procs for 100 steps with 32000 atoms

Pair  time (%) = 2.62235 (95.5209)
Neigh time (%) = 0.0214692 (0.782031)
Comm  time (%) = 0.0812815 (2.96073)
Outpt time (%) = 4.88758e-05 (0.00178033)
Other time (%) = 0.0201654 (0.734538)

Nlocal:    8000 ave 8015 max 7978 min
Histogram: 1 0 0 0 0 0 1 1 0 1
Nghost:    4995 ave 5017 max 4980 min
Histogram: 1 0 1 1 0 0 0 0 0 1
Neighs:    0 ave 0 max 0 min
Histogram: 4 0 0 0 0 0 0 0 0 0
FullNghs:  223704 ave 224108 max 223131 min
Histogram: 1 0 0 0 0 0 1 1 0 1

Total # of neighbors = 894818
Ave neighs/atom = 27.9631
Neighbor list builds = 2
Dangerous builds = 0
