LAMMPS (24 Oct 2018)
Lattice spacing in x,y,z = 8.18172 8.18172 8.18172
Created orthogonal box = (0 0 0) to (8.18172 8.18172 8.18172)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 0.000123978 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 3 3 3
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.434 | 4.434 | 4.434 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0      8.18172            0      8.18172            0      8.18172   -6.0467736   -39904.387   -39904.387   -39904.387   -39904.387 2.1435355e-11 2.2896857e-11 2.2896857e-11 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    162 ave 162 max 162 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  224 ave 224 max 224 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 224
Ave neighs/atom = 28
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -0.755846699956134 eV/atom
Lattice spacing in x,y,z = 7.63352 7.63352 7.63352
Created orthogonal box = (0 0 0) to (7.63352 7.63352 7.63352)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.00407e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 3 3 3
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.434 | 4.434 | 4.434 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     7.633515            0     7.633515            0     7.633515   -9.2342349   -63189.758   -63189.758   -63189.758   -63189.758 2.3993751e-12 2.3993751e-12 1.9994793e-12 
Loop time of 1.19209e-06 on 1 procs for 0 steps with 8 atoms

83.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 1.192e-06  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    162 ave 162 max 162 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  224 ave 224 max 224 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 224
Ave neighs/atom = 28
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -1.15427936314483 eV/atom
Lattice spacing in x,y,z = 7.29376 7.29376 7.29376
Created orthogonal box = (0 0 0) to (7.29376 7.29376 7.29376)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.50475e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     7.293759            0     7.293759            0     7.293759   -11.776804   -78163.888   -78163.888   -78163.888   -78163.888 -9.1684592e-12 -1.0543728e-11 -1.0543728e-11 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 272
Ave neighs/atom = 34
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -1.47210055525978 eV/atom
Lattice spacing in x,y,z = 7.04691 7.04691 7.04691
Created orthogonal box = (0 0 0) to (7.04691 7.04691 7.04691)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.21865e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     7.046908            0     7.046908            0     7.046908   -13.664699   -79152.167   -79152.167   -79152.167   -79152.167 -2.0332219e-12 -5.0830547e-12 -1.0166109e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 272
Ave neighs/atom = 34
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -1.708087425714 eV/atom
Lattice spacing in x,y,z = 6.85291 6.85291 6.85291
Created orthogonal box = (0 0 0) to (6.85291 6.85291 6.85291)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 6.8903e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.852913            0     6.852913            0     6.852913   -15.009226   -73324.388   -73324.388   -73324.388   -73324.388 9.6723718e-12 4.9743626e-12 5.2507161e-12 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

104.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 272
Ave neighs/atom = 34
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -1.87615323555554 eV/atom
Lattice spacing in x,y,z = 6.69308 6.69308 6.69308
Created orthogonal box = (0 0 0) to (6.69308 6.69308 6.69308)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.21865e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.693083            0     6.693083            0     6.693083   -15.978018   -67835.215   -67835.215   -67835.215   -67835.215 -2.0763951e-12 -5.0426739e-12 -5.0426739e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  368 ave 368 max 368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 368
Ave neighs/atom = 46
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -1.99725227134436 eV/atom
Lattice spacing in x,y,z = 6.55717 6.55717 6.55717
Created orthogonal box = (0 0 0) to (6.55717 6.55717 6.55717)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.50475e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.557168            0     6.557168            0     6.557168   -16.712443   -63863.815   -63863.815   -63863.815   -63863.815 -5.6782455e-12 6.3091617e-12 7.2555359e-12 
Loop time of 1.19209e-06 on 1 procs for 0 steps with 8 atoms

83.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 1.192e-06  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  368 ave 368 max 368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 368
Ave neighs/atom = 46
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.08905543235413 eV/atom
Lattice spacing in x,y,z = 6.43893 6.43893 6.43893
Created orthogonal box = (0 0 0) to (6.43893 6.43893 6.43893)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.00407e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.438933            0     6.438933            0     6.438933   -17.299012   -61842.689   -61842.689   -61842.689   -61842.689 -3.3315695e-12 1.6657847e-12 9.9947084e-13 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  368 ave 368 max 368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 368
Ave neighs/atom = 46
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.16237645205153 eV/atom
Lattice spacing in x,y,z = 6.3343 6.3343 6.3343
Created orthogonal box = (0 0 0) to (6.3343 6.3343 6.3343)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 4.69685e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.334303            0     6.334303            0     6.334303   -17.788522   -60732.554   -60732.554   -60732.554   -60732.554 1.0409734e-12 2.4407297e-12 5.2402422e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  368 ave 368 max 368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 368
Ave neighs/atom = 46
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.22356519417135 eV/atom
Lattice spacing in x,y,z = 6.24047 6.24047 6.24047
Created orthogonal box = (0 0 0) to (6.24047 6.24047 6.24047)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.98023e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.240469            0     6.240469            0     6.240469   -18.208071   -60140.427   -60140.427   -60140.427   -60140.427 -1.927657e-13 -5.6821878e-12 -4.5842944e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  368 ave 368 max 368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 368
Ave neighs/atom = 46
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.2760089018078 eV/atom
Lattice spacing in x,y,z = 6.15541 6.15541 6.15541
Created orthogonal box = (0 0 0) to (6.15541 6.15541 6.15541)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.59876e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.155409            0     6.155409            0     6.155409   -18.575858   -60248.089   -60248.089   -60248.089   -60248.089 -1.7386834e-12 5.4930292e-13 2.0750616e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  368 ave 368 max 368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 368
Ave neighs/atom = 46
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.32198230515129 eV/atom
Lattice spacing in x,y,z = 6.07762 6.07762 6.07762
Created orthogonal box = (0 0 0) to (6.07762 6.07762 6.07762)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.90871e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.077622            0     6.077622            0     6.077622   -18.906477   -61252.595   -61252.595   -61252.595   -61252.595 9.3120999e-12 5.7465046e-12 5.7461177e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  368 ave 368 max 368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 368
Ave neighs/atom = 46
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.36330961111129 eV/atom
Lattice spacing in x,y,z = 6.00596 6.00596 6.00596
Created orthogonal box = (0 0 0) to (6.00596 6.00596 6.00596)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.31402e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     6.005961            0     6.005961            0     6.005961   -19.210445   -63008.321   -63008.321   -63008.321   -63008.321 -5.2514744e-12 -5.0450076e-12 -6.4818565e-12 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

209.7% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  368 ave 368 max 368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 368
Ave neighs/atom = 46
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.40130565455145 eV/atom
Lattice spacing in x,y,z = 5.93953 5.93953 5.93953
Created orthogonal box = (0 0 0) to (5.93953 5.93953 5.93953)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.38554e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.939532            0     5.939532            0     5.939532   -19.493545    -64354.48    -64354.48    -64354.48    -64354.48 3.4963833e-12 4.3457123e-12 6.0435411e-12 
Loop time of 1.19209e-06 on 1 procs for 0 steps with 8 atoms

83.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 1.192e-06  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  560 ave 560 max 560 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 560
Ave neighs/atom = 70
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.43669308205721 eV/atom
Lattice spacing in x,y,z = 5.87762 5.87762 5.87762
Created orthogonal box = (0 0 0) to (5.87762 5.87762 5.87762)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.79086e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.332 | 4.332 | 4.332 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.877622            0     5.877622            0     5.877622   -19.753534   -63717.415   -63717.415   -63717.415   -63717.415 -7.9128682e-12 -7.0406946e-12 -9.0117469e-12 
Loop time of 1.19209e-06 on 1 procs for 0 steps with 8 atoms

167.8% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 1.192e-06  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    272 ave 272 max 272 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  560 ave 560 max 560 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 560
Ave neighs/atom = 70
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.46919170304019 eV/atom
Lattice spacing in x,y,z = 5.81966 5.81966 5.81966
Created orthogonal box = (0 0 0) to (5.81966 5.81966 5.81966)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.69413e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.819656            0     5.819656            0     5.819656   -19.985427   -60798.472   -60798.472   -60798.472   -60798.472 2.1013955e-11 2.6090301e-11 2.5864685e-11 
Loop time of 1.19209e-06 on 1 procs for 0 steps with 8 atoms

83.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 1.192e-06  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  560 ave 560 max 560 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 560
Ave neighs/atom = 70
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.49817834870418 eV/atom
Lattice spacing in x,y,z = 5.76516 5.76516 5.76516
Created orthogonal box = (0 0 0) to (5.76516 5.76516 5.76516)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.09944e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0      5.76516            0      5.76516            0      5.76516    -20.18574   -55836.711   -55836.711   -55836.711   -55836.711 2.932654e-11 3.1299169e-11 3.385017e-11 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

209.7% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  560 ave 560 max 560 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 560
Ave neighs/atom = 70
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.52321752031457 eV/atom
Lattice spacing in x,y,z = 5.71374 5.71374 5.71374
Created orthogonal box = (0 0 0) to (5.71374 5.71374 5.71374)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.48091e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.713744            0     5.713744            0     5.713744   -20.353252    -49567.64    -49567.64    -49567.64    -49567.64 -3.900562e-11 -3.8886422e-11 -4.0912785e-11 
Loop time of 1.19209e-06 on 1 procs for 0 steps with 8 atoms

83.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 1.192e-06  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  560 ave 560 max 560 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 560
Ave neighs/atom = 70
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.5441565517056 eV/atom
Lattice spacing in x,y,z = 5.66508 5.66508 5.66508
Created orthogonal box = (0 0 0) to (5.66508 5.66508 5.66508)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.69549e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.665076            0     5.665076            0     5.665076   -20.489226     -42396.3     -42396.3     -42396.3     -42396.3 -4.384323e-11 -4.5433082e-11 -4.6808915e-11 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  560 ave 560 max 560 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 560
Ave neighs/atom = 70
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.56115323233346 eV/atom
Lattice spacing in x,y,z = 5.61888 5.61888 5.61888
Created orthogonal box = (0 0 0) to (5.61888 5.61888 5.61888)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.69413e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.618879            0     5.618879            0     5.618879   -20.595443   -34589.949   -34589.949   -34589.949   -34589.949 -2.8690572e-13 1.0927877e-12 7.7552673e-13 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.57443041887583 eV/atom
Lattice spacing in x,y,z = 5.57491 5.57491 5.57491
Created orthogonal box = (0 0 0) to (5.57491 5.57491 5.57491)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.69413e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.574913            0     5.574913            0     5.574913   -20.674212   -26338.509   -26338.509   -26338.509   -26338.509 -2.0235483e-11 -2.0508177e-11 -1.839079e-11 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

104.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.58427648368351 eV/atom
Lattice spacing in x,y,z = 5.53297 5.53297 5.53297
Created orthogonal box = (0 0 0) to (5.53297 5.53297 5.53297)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.48091e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.532974            0     5.532974            0     5.532974   -20.727704   -17679.722   -17679.722   -17679.722   -17679.722 -5.4231625e-11 -5.1079172e-11 -5.1998039e-11 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

209.7% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.59096294040804 eV/atom
Lattice spacing in x,y,z = 5.49288 5.49288 5.49288
Created orthogonal box = (0 0 0) to (5.49288 5.49288 5.49288)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 4.79221e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.492881            0     5.492881            0     5.492881   -20.758106   -8875.0289   -8875.0289   -8875.0289   -8875.0289 -3.6496299e-12 1.182304e-12 -9.642905e-13 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

209.7% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.59476319327254 eV/atom
Lattice spacing in x,y,z = 5.45448 5.45448 5.45448
Created orthogonal box = (0 0 0) to (5.45448 5.45448 5.45448)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 5.48363e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0      5.45448            0      5.45448            0      5.45448    -20.76777   0.82685088   0.82685088   0.82685088   0.82685088 -2.8430771e-12 -2.2950141e-12 -3.8021875e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.59597128274146 eV/atom
Lattice spacing in x,y,z = 5.42834 5.42834 5.42834
Created orthogonal box = (0 0 0) to (5.42834 5.42834 5.42834)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.71797e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.428337            0     5.428337            0     5.428337   -20.763224    6322.7658    6322.7658    6322.7658    6322.7658 -2.6610756e-11 -2.5229394e-11 -2.2449296e-11 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.59540297252895 eV/atom
Lattice spacing in x,y,z = 5.40082 5.40082 5.40082
Created orthogonal box = (0 0 0) to (5.40082 5.40082 5.40082)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.38554e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.400823            0     5.400823            0     5.400823   -20.748491    13244.807    13244.807    13244.807    13244.807 -4.7789194e-11 -5.5609244e-11  -5.3351e-11 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

209.7% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.59356140341379 eV/atom
Lattice spacing in x,y,z = 5.37179 5.37179 5.37179
Created orthogonal box = (0 0 0) to (5.37179 5.37179 5.37179)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.40939e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.371786            0     5.371786            0     5.371786   -20.721638    20874.088    20874.088    20874.088    20874.088 -1.6630236e-12 1.7750872e-12 2.366783e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.59020471065079 eV/atom
Lattice spacing in x,y,z = 5.34105 5.34105 5.34105
Created orthogonal box = (0 0 0) to (5.34105 5.34105 5.34105)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 5.29289e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.341047            0     5.341047            0     5.341047   -20.680245    29342.583    29342.583    29342.583    29342.583 3.5388581e-12 -1.9336029e-12 -3.7212734e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.58503062349836 eV/atom
Lattice spacing in x,y,z = 5.30839 5.30839 5.30839
Created orthogonal box = (0 0 0) to (5.30839 5.30839 5.30839)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.90871e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.308394            0     5.308394            0     5.308394   -20.621257    38828.509    38828.509    38828.509    38828.509 1.3470669e-12 -2.2110478e-12 -4.2920339e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.57765717584163 eV/atom
Lattice spacing in x,y,z = 5.27357 5.27357 5.27357
Created orthogonal box = (0 0 0) to (5.27357 5.27357 5.27357)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.38554e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.273573            0     5.273573            0     5.273573   -20.539645    51207.906    51207.906    51207.906    51207.906 -6.2518427e-11 -6.5531592e-11 -6.2840589e-11 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

209.7% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.56745557120189 eV/atom
Lattice spacing in x,y,z = 5.23628 5.23628 5.23628
Created orthogonal box = (0 0 0) to (5.23628 5.23628 5.23628)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 4.60148e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.236275            0     5.236275            0     5.236275   -20.424981    68446.018    68446.018    68446.018    68446.018 -1.5515894e-11 -1.8622944e-11 -2.1062124e-11 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.55312266323819 eV/atom
Lattice spacing in x,y,z = 5.19612 5.19612 5.19612
Created orthogonal box = (0 0 0) to (5.19612 5.19612 5.19612)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 4.88758e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.196121            0     5.196121            0     5.196121   -20.262816     90459.98     90459.98     90459.98     90459.98 1.0420501e-11 -2.2584355e-12 -1.6641104e-12 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  688 ave 688 max 688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 688
Ave neighs/atom = 86
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.53285206045645 eV/atom
Lattice spacing in x,y,z = 5.15264 5.15264 5.15264
Created orthogonal box = (0 0 0) to (5.15264 5.15264 5.15264)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 5.19753e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.152637            0     5.152637            0     5.152637   -20.037829    116393.75    116393.75    116393.75    116393.75 6.7248092e-12 -3.6976292e-12 -1.4140384e-11 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  784 ave 784 max 784 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 784
Ave neighs/atom = 98
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.50472859101199 eV/atom
Lattice spacing in x,y,z = 5.10522 5.10522 5.10522
Created orthogonal box = (0 0 0) to (5.10522 5.10522 5.10522)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 6.29425e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0      5.10522            0      5.10522            0      5.10522   -19.730545    147301.93    147301.93    147301.93    147301.93 -7.1771229e-11 -1.0652889e-10 -1.0786572e-10 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  784 ave 784 max 784 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 784
Ave neighs/atom = 98
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.46631815725633 eV/atom
Lattice spacing in x,y,z = 5.05309 5.05309 5.05309
Created orthogonal box = (0 0 0) to (5.05309 5.05309 5.05309)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 4.50611e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     5.053089            0     5.053089            0     5.053089   -19.314225    183022.79    183022.79    183022.79    183022.79 1.0339773e-12 -3.446591e-13 -3.446591e-13 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

104.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  784 ave 784 max 784 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 784
Ave neighs/atom = 98
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.41427810499283 eV/atom
Lattice spacing in x,y,z = 4.9952 4.9952 4.9952
Created orthogonal box = (0 0 0) to (4.9952 4.9952 4.9952)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.88486e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     4.995199            0     4.995199            0     4.995199   -18.766878    215797.73    215797.73    215797.73    215797.73 -1.7132197e-10 -1.2139487e-10 -1.0988867e-10 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

104.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  784 ave 784 max 784 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 784
Ave neighs/atom = 98
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.34585979518511 eV/atom
Lattice spacing in x,y,z = 4.93012 4.93012 4.93012
Created orthogonal box = (0 0 0) to (4.93012 4.93012 4.93012)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 7.82013e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.333 | 4.333 | 4.333 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     4.930119            0     4.930119            0     4.930119   -18.076675    242416.67    242416.67    242416.67    242416.67 4.4114252e-11 1.6588072e-10 1.5103681e-10 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    420 ave 420 max 420 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  976 ave 976 max 976 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 976
Ave neighs/atom = 122
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.25958443066536 eV/atom
Lattice spacing in x,y,z = 4.85581 4.85581 4.85581
Created orthogonal box = (0 0 0) to (4.85581 4.85581 4.85581)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 5.57899e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.335 | 4.335 | 4.335 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     4.855808            0     4.855808            0     4.855808   -17.237762    258734.53    258734.53    258734.53    258734.53 -1.6531155e-11 4.0975903e-11 3.320796e-11 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    612 ave 612 max 612 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  976 ave 976 max 976 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 976
Ave neighs/atom = 122
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.1547202245033 eV/atom
Lattice spacing in x,y,z = 4.76921 4.76921 4.76921
Created orthogonal box = (0 0 0) to (4.76921 4.76921 4.76921)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 4.60148e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.335 | 4.335 | 4.335 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     4.769205            0     4.769205            0     4.769205   -16.261539    257290.08    257290.08    257290.08    257290.08 -1.4209621e-10 -9.6233931e-11 -1.1816584e-10 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    612 ave 612 max 612 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  976 ave 976 max 976 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 976
Ave neighs/atom = 122
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -2.03269238938565 eV/atom
Lattice spacing in x,y,z = 4.66542 4.66542 4.66542
Created orthogonal box = (0 0 0) to (4.66542 4.66542 4.66542)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.50475e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.335 | 4.335 | 4.335 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     4.665423            0     4.665423            0     4.665423   -15.102397     302915.3     302915.3     302915.3     302915.3 5.2051396e-10 3.9488776e-10 4.0287966e-10 
Loop time of 0 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 0          |            |       |  0.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    612 ave 612 max 612 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  976 ave 976 max 976 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 976
Ave neighs/atom = 122
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -1.88779960339856 eV/atom
Lattice spacing in x,y,z = 4.53592 4.53592 4.53592
Created orthogonal box = (0 0 0) to (4.53592 4.53592 4.53592)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 3.40939e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.335 | 4.335 | 4.335 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0     4.535917            0     4.535917            0     4.535917   -13.113573    505260.86    505260.86    505260.86    505260.86 2.2860213e-10 2.8959447e-10 2.8625895e-10 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

104.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    612 ave 612 max 612 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  1168 ave 1168 max 1168 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1168
Ave neighs/atom = 146
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -1.6391966757247 eV/atom
Lattice spacing in x,y,z = 4.36358 4.36358 4.36358
Created orthogonal box = (0 0 0) to (4.36358 4.36358 4.36358)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  Time spent = 2.81334e-05 secs
WARNING: No fixes defined, atoms won't move (../verlet.cpp:55)
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.3
  ghost atom cutoff = 7.3
  binsize = 3.65, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7.3
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 4.335 | 4.335 | 4.335 Mbytes
Step Atoms Xlo Xhi Ylo Yhi Zlo Zhi PotEng Press Pxx Pyy Pzz Pxy Pxz Pyz 
       0        8            0      4.36358            0      4.36358            0      4.36358   -8.1914659    1110214.9    1110214.9    1110214.9    1110214.9 -3.7411829e-10 -4.5118987e-10 -4.277573e-10 
Loop time of 9.53674e-07 on 1 procs for 0 steps with 8 atoms

104.9% CPU use with 1 MPI tasks x no OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0          | 0          | 0          |   0.0 |  0.00
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 0          | 0          | 0          |   0.0 |  0.00
Output  | 0          | 0          | 0          |   0.0 |  0.00
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 9.537e-07  |            |       |100.00

Nlocal:    8 ave 8 max 8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    612 ave 612 max 612 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  1264 ave 1264 max 1264 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1264
Ave neighs/atom = 158
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy = -1.02393323428705 eV/atom
Total wall time: 0:00:04