LAMMPS (21 Feb 2017)
  using 1 OpenMP thread(s) per MPI task

processors * * 1
units metal
boundary p p f
read_data adatom.data
  orthogonal box = (0 0 0) to (17.1214 14.8276 39.3197)
  2 by 2 by 1 MPI processor grid
  reading atoms ...
  181 atoms

pair_style agni
pair_coeff * * Al_jpc.agni Al
Reading potential file Al_jpc.agni with DATE: 2017-02-24

neighbor 0.3 bin
neigh_modify delay 2 check yes

timestep 0.0005
velocity all create 500 12345
fix 1 all nvt temp 250 250 0.2
fix 5 all momentum 1 linear 1 1 1

thermo 100
thermo_style custom step ke temp

# dump MyDump all custom 250 dump.atoms id type x y z vx vy vz fx fy fz

run 1000
Neighbor list info ...
  update every 1 steps, delay 2 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 8.3
  ghost atom cutoff = 8.3
  binsize = 4.15, bins = 5 4 10
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair agni, perpetual
      attributes: full, newton on
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Memory usage per processor = 3.06041 Mbytes
Step KinEng Temp 
       0    11.633413          500 
     100    4.6059941    197.96401 
     200    7.3700154    316.76067 
     300    6.0443913    259.78581 
     400    6.1631193     264.8887 
     500    6.2647281    269.25581 
     600    5.2732537    226.64259 
     700     5.651448    242.89725 
     800    6.5572405    281.82789 
     900    6.0576741     260.3567 
    1000     6.562224    282.04208 
Loop time of 14.5263 on 4 procs for 1000 steps with 181 atoms

Performance: 2.974 ns/day, 8.070 hours/ns, 68.841 timesteps/s
99.3% CPU use with 4 MPI tasks x 1 OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 12.858     | 13.227     | 13.574     |   8.0 | 91.06
Neigh   | 0.0056965  | 0.0058173  | 0.0060787  |   0.2 |  0.04
Comm    | 0.92934    | 1.276      | 1.6455     |  25.7 |  8.78
Output  | 0.00013971 | 0.00017625 | 0.00025463 |   0.0 |  0.00
Modify  | 0.012693   | 0.012756   | 0.012911   |   0.1 |  0.09
Other   |            | 0.004066   |            |       |  0.03

Nlocal:    45.25 ave 52 max 40 min
Histogram: 1 0 0 1 1 0 0 0 0 1
Nghost:    376.5 ave 382 max 366 min
Histogram: 1 0 0 0 0 0 0 0 2 1
Neighs:    0 ave 0 max 0 min
Histogram: 4 0 0 0 0 0 0 0 0 0
FullNghs:  4871 ave 5578 max 4374 min
Histogram: 1 0 1 1 0 0 0 0 0 1

Total # of neighbors = 19484
Ave neighs/atom = 107.646
Neighbor list builds = 33
Dangerous builds = 0

Please see the log.cite file for references relevant to this simulation

Total wall time: 0:00:14
