LAMMPS (23 Jun 2022)
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.90249 3.90249 3.90249
Created orthogonal box = (0 0 0) to (3.90249 3.90249 3.90249)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.90249 3.90249 3.90249)
  create_atoms CPU = 0.001 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.


CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE

Your simulation uses code contributions which should be cited:
- OpenKIM: https://doi.org/10.1007/s11837-011-0102-6
- OpenKIM potential: https://openkim.org/cite/MO_584345505904_000#item-citation
The log file lists these citations in BibTeX format.

CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE-CITE

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.097 | 5.097 | 5.097 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.90249        0              3.90249        0              3.90249       -59.821383     -169350.53     -169350.53     -169350.53     -169350.53     -169350.53      2.73104e-11   -1.4066727e-10 -1.6086948e-10
Loop time of 8.51e-06 on 1 procs for 0 steps with 8 atoms

152.8% CPU use with 1 MPI tasks x 1 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   |            | 8.51e-06   |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:            856 ave         856 max         856 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:         1520 ave        1520 max        1520 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1520
Ave neighs/atom = 190
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0833222886086098 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.641009 3.641009 3.641009
Created orthogonal box = (0 0 0) to (3.641009 3.641009 3.641009)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.641009 3.641009 3.641009)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 2 2 2
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.097 | 5.097 | 5.097 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.641009       0              3.641009       0              3.641009      -60.944797      140296.81      140296.81      140296.81      140296.81      140296.81     -9.066588e-11  -3.2774095e-11 -7.9547447e-11
Loop time of 6.044e-06 on 1 procs for 0 steps with 8 atoms

165.5% CPU use with 1 MPI tasks x 1 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   |            | 6.044e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:            856 ave         856 max         856 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:         2192 ave        2192 max        2192 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2192
Ave neighs/atom = 274
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.22374914609886 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.478953 3.478953 3.478953
Created orthogonal box = (0 0 0) to (3.478953 3.478953 3.478953)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.478953 3.478953 3.478953)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.135 | 5.135 | 5.135 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.478953       0              3.478953       0              3.478953      -60.064807      203747.74      203747.74      203747.74      203747.74      203747.74      5.3614795e-11 -3.5140876e-11  4.1993305e-11
Loop time of 6.014e-06 on 1 procs for 0 steps with 8 atoms

199.5% CPU use with 1 MPI tasks x 1 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   |            | 6.014e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1158 ave        1158 max        1158 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:         2240 ave        2240 max        2240 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2240
Ave neighs/atom = 280
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.113750409647148 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.361211 3.361211 3.361211
Created orthogonal box = (0 0 0) to (3.361211 3.361211 3.361211)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.361211 3.361211 3.361211)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.135 | 5.135 | 5.135 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.361211       0              3.361211       0              3.361211      -59.850633      7662.1813      7662.1813      7662.1813      7662.1813      7662.1813     -9.9533749e-11 -9.5043984e-11 -1.0845596e-10
Loop time of 6.034e-06 on 1 procs for 0 steps with 8 atoms

165.7% CPU use with 1 MPI tasks x 1 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   |            | 6.034e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1158 ave        1158 max        1158 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:         2336 ave        2336 max        2336 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2336
Ave neighs/atom = 292
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0869786344706096 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.26868 3.26868 3.26868
Created orthogonal box = (0 0 0) to (3.26868 3.26868 3.26868)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.26868 3.26868 3.26868)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.135 | 5.135 | 5.135 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.26868        0              3.26868        0              3.26868       -59.783985      84604.712      84604.712      84604.712      84604.712      84604.712     -2.3681085e-11 -2.3267375e-10 -2.7094722e-10
Loop time of 6.004e-06 on 1 procs for 0 steps with 8 atoms

183.2% CPU use with 1 MPI tasks x 1 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   |            | 6.004e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1158 ave        1158 max        1158 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:         2624 ave        2624 max        2624 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2624
Ave neighs/atom = 328
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0786475479284228 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.192445 3.192445 3.192445
Created orthogonal box = (0 0 0) to (3.192445 3.192445 3.192445)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.192445 3.192445 3.192445)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.135 | 5.135 | 5.135 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.192445       0              3.192445       0              3.192445      -59.670534      21400.137      21400.137      21400.137      21400.137      21400.137     -1.4710623e-10 -1.887028e-10  -2.3873347e-10
Loop time of 5.994e-06 on 1 procs for 0 steps with 8 atoms

200.2% CPU use with 1 MPI tasks x 1 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   |            | 5.994e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1158 ave        1158 max        1158 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:         2848 ave        2848 max        2848 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2848
Ave neighs/atom = 356
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0644661801666224 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.127616 3.127616 3.127616
Created orthogonal box = (0 0 0) to (3.127616 3.127616 3.127616)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.127616 3.127616 3.127616)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.135 | 5.135 | 5.135 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.127616       0              3.127616       0              3.127616      -59.657817      12679.438      12679.438      12679.438      12679.438      12679.438     -1.8266913e-10 -2.2859972e-10 -2.3962602e-10
Loop time of 6.054e-06 on 1 procs for 0 steps with 8 atoms

165.2% CPU use with 1 MPI tasks x 1 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   |            | 6.054e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1158 ave        1158 max        1158 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:         3040 ave        3040 max        3040 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3040
Ave neighs/atom = 380
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0628765436344603 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.071221 3.071221 3.071221
Created orthogonal box = (0 0 0) to (3.071221 3.071221 3.071221)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.071221 3.071221 3.071221)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.144 | 5.144 | 5.144 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.071221       0              3.071221       0              3.071221      -59.642472      15535.324      15535.324      15535.324      15535.324      15535.324     -7.8510292e-11 -1.6577526e-10 -1.9080405e-10
Loop time of 6.124e-06 on 1 procs for 0 steps with 8 atoms

196.0% CPU use with 1 MPI tasks x 1 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   |            | 6.124e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1522 ave        1522 max        1522 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:         3328 ave        3328 max        3328 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3328
Ave neighs/atom = 416
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0609584246154222 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 3.021315 3.021315 3.021315
Created orthogonal box = (0 0 0) to (3.021315 3.021315 3.021315)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (3.021315 3.021315 3.021315)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.144 | 5.144 | 5.144 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              3.021315       0              3.021315       0              3.021315      -59.620876      25170.432      25170.432      25170.432      25170.432      25170.432      5.8687237e-11 -8.2522087e-11 -9.7524958e-11
Loop time of 6.205e-06 on 1 procs for 0 steps with 8 atoms

193.4% CPU use with 1 MPI tasks x 1 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   |            | 6.205e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1522 ave        1522 max        1522 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:         3328 ave        3328 max        3328 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3328
Ave neighs/atom = 416
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0582590201921471 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.976558 2.976558 2.976558
Created orthogonal box = (0 0 0) to (2.976558 2.976558 2.976558)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.976558 2.976558 2.976558)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.144 | 5.144 | 5.144 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.976558       0              2.976558       0              2.976558      -59.59569       55867.526      55867.526      55867.526      55867.526      55867.526      1.9329103e-11  5.7160659e-11 -3.9837251e-11
Loop time of 7.397e-06 on 1 procs for 0 steps with 8 atoms

297.4% CPU use with 1 MPI tasks x 1 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   |            | 7.397e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1522 ave        1522 max        1522 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:         3520 ave        3520 max        3520 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3520
Ave neighs/atom = 440
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0551107047539849 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.935987 2.935987 2.935987
Created orthogonal box = (0 0 0) to (2.935987 2.935987 2.935987)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.935987 2.935987 2.935987)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.144 | 5.144 | 5.144 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.935987       0              2.935987       0              2.935987      -59.557128      42476.602      42476.602      42476.602      42476.602      42476.602      8.1678021e-12 -8.5645239e-11 -8.5302054e-11
Loop time of 8.019e-06 on 1 procs for 0 steps with 8 atoms

174.6% CPU use with 1 MPI tasks x 1 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   |            | 8.019e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1522 ave        1522 max        1522 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:         3520 ave        3520 max        3520 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3520
Ave neighs/atom = 440
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0502904445061976 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.898884 2.898884 2.898884
Created orthogonal box = (0 0 0) to (2.898884 2.898884 2.898884)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.898884 2.898884 2.898884)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.144 | 5.144 | 5.144 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.898884       0              2.898884       0              2.898884      -59.538264      28638.012      28638.012      28638.012      28638.012      28638.012      9.8794928e-12 -2.3694382e-10 -2.2484314e-10
Loop time of 6.044e-06 on 1 procs for 0 steps with 8 atoms

198.5% CPU use with 1 MPI tasks x 1 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   |            | 6.044e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1522 ave        1522 max        1522 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:         3712 ave        3712 max        3712 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3712
Ave neighs/atom = 464
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0479325195955598 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.864704 2.864704 2.864704
Created orthogonal box = (0 0 0) to (2.864704 2.864704 2.864704)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.864704 2.864704 2.864704)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.144 | 5.144 | 5.144 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.864704       0              2.864704       0              2.864704      -59.520962      37515.372      37515.372      37515.372      37515.372      37515.372      4.588893e-11  -9.5597936e-11 -1.0010518e-10
Loop time of 5.894e-06 on 1 procs for 0 steps with 8 atoms

169.7% CPU use with 1 MPI tasks x 1 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   |            | 5.894e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1522 ave        1522 max        1522 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:         3712 ave        3712 max        3712 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3712
Ave neighs/atom = 464
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0457696950076976 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.833018 2.833018 2.833018
Created orthogonal box = (0 0 0) to (2.833018 2.833018 2.833018)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.833018 2.833018 2.833018)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.144 | 5.144 | 5.144 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.833018       0              2.833018       0              2.833018      -59.503666      27542.139      27542.139      27542.139      27542.139      27542.139     -9.7863729e-12  2.0155268e-10  1.7503932e-10
Loop time of 6.064e-06 on 1 procs for 0 steps with 8 atoms

181.4% CPU use with 1 MPI tasks x 1 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   |            | 6.064e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1522 ave        1522 max        1522 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:         3904 ave        3904 max        3904 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3904
Ave neighs/atom = 488
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0436077786180595 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.803489 2.803489 2.803489
Created orthogonal box = (0 0 0) to (2.803489 2.803489 2.803489)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.803489 2.803489 2.803489)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.144 | 5.144 | 5.144 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.803489       0              2.803489       0              2.803489      -59.49734       2732.6166      2732.6166      2732.6166      2732.6166      2732.6166     -3.1554071e-12  5.7200377e-11  6.3608751e-11
Loop time of 6.074e-06 on 1 procs for 0 steps with 8 atoms

197.6% CPU use with 1 MPI tasks x 1 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   |            | 6.074e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1522 ave        1522 max        1522 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:         4192 ave        4192 max        4192 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4192
Ave neighs/atom = 524
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0428169765466473 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.77584 2.77584 2.77584
Created orthogonal box = (0 0 0) to (2.77584 2.77584 2.77584)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.77584 2.77584 2.77584)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.77584        0              2.77584        0              2.77584       -59.499667     -14206.009     -14206.009     -14206.009     -14206.009     -14206.009      1.9966377e-11 -2.7184807e-11 -5.2243933e-11
Loop time of 5.793e-06 on 1 procs for 0 steps with 8 atoms

189.9% CPU use with 1 MPI tasks x 1 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   |            | 5.793e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         4192 ave        4192 max        4192 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4192
Ave neighs/atom = 524
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0431079085530097 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.749847 2.749847 2.749847
Created orthogonal box = (0 0 0) to (2.749847 2.749847 2.749847)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.749847 2.749847 2.749847)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.749847       0              2.749847       0              2.749847      -59.506346     -17589.761     -17589.761     -17589.761     -17589.761     -17589.761      6.9496691e-11  5.7886361e-11  2.8964988e-11
Loop time of 6.364e-06 on 1 procs for 0 steps with 8 atoms

188.6% CPU use with 1 MPI tasks x 1 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   |            | 6.364e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         4192 ave        4192 max        4192 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4192
Ave neighs/atom = 524
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0439427738611222 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.725323 2.725323 2.725323
Created orthogonal box = (0 0 0) to (2.725323 2.725323 2.725323)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.725323 2.725323 2.725323)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.725323       0              2.725323       0              2.725323      -59.511756     -16328.519     -16328.519     -16328.519     -16328.519     -16328.519      3.2722092e-12  9.6079093e-11  9.1701236e-11
Loop time of 6.305e-06 on 1 procs for 0 steps with 8 atoms

190.3% CPU use with 1 MPI tasks x 1 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   |            | 6.305e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         4768 ave        4768 max        4768 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4768
Ave neighs/atom = 596
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0446189675481596 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.70211 2.70211 2.70211
Created orthogonal box = (0 0 0) to (2.70211 2.70211 2.70211)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.70211 2.70211 2.70211)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.70211        0              2.70211        0              2.70211       -59.513591      28693.86       28693.86       28693.86       28693.86       28693.86       4.9971073e-11  1.6775995e-10  1.6688918e-10
Loop time of 6.344e-06 on 1 procs for 0 steps with 8 atoms

173.4% CPU use with 1 MPI tasks x 1 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   |            | 6.344e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         5056 ave        5056 max        5056 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5056
Ave neighs/atom = 632
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0448484080498597 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.680075 2.680075 2.680075
Created orthogonal box = (0 0 0) to (2.680075 2.680075 2.680075)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.680075 2.680075 2.680075)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.680075       0              2.680075       0              2.680075      -59.509574     -4538.0167     -4538.0167     -4538.0167     -4538.0167     -4538.0167     -2.6472349e-11 -8.3290639e-11 -6.671048e-11 
Loop time of 6.144e-06 on 1 procs for 0 steps with 8 atoms

179.0% CPU use with 1 MPI tasks x 1 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   |            | 6.144e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         5056 ave        5056 max        5056 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5056
Ave neighs/atom = 632
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0443462023956727 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.659104 2.659104 2.659104
Created orthogonal box = (0 0 0) to (2.659104 2.659104 2.659104)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.659104 2.659104 2.659104)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.659104       0              2.659104       0              2.659104      -59.510774     -3274.7222     -3274.7222     -3274.7222     -3274.7222     -3274.7222      1.1680435e-11  2.1789285e-11  2.6360623e-11
Loop time of 6.115e-06 on 1 procs for 0 steps with 8 atoms

196.2% CPU use with 1 MPI tasks x 1 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   |            | 6.115e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         5056 ave        5056 max        5056 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5056
Ave neighs/atom = 632
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0444962441923726 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.6391 2.6391 2.6391
Created orthogonal box = (0 0 0) to (2.6391 2.6391 2.6391)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.6391 2.6391 2.6391)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.6391         0              2.6391         0              2.6391        -59.511391     -1554.9477     -1554.9477     -1554.9477     -1554.9477     -1554.9477     -2.9947355e-12 -2.8280511e-12  5.7828713e-13
Loop time of 6.124e-06 on 1 procs for 0 steps with 8 atoms

179.6% CPU use with 1 MPI tasks x 1 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   |            | 6.124e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         5056 ave        5056 max        5056 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5056
Ave neighs/atom = 632
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0445733854246226 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.619976 2.619976 2.619976
Created orthogonal box = (0 0 0) to (2.619976 2.619976 2.619976)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.619976 2.619976 2.619976)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.619976       0              2.619976       0              2.619976      -59.51165      -625.91218     -625.91218     -625.91218     -625.91218     -625.91218      2.4179849e-12 -8.1061849e-13  8.3083714e-13
Loop time of 6.365e-06 on 1 procs for 0 steps with 8 atoms

204.2% CPU use with 1 MPI tasks x 1 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   |            | 6.365e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         5056 ave        5056 max        5056 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5056
Ave neighs/atom = 632
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0446056674036601 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.60166 2.60166 2.60166
Created orthogonal box = (0 0 0) to (2.60166 2.60166 2.60166)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.60166 2.60166 2.60166)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.60166        0              2.60166        0              2.60166       -59.511726      0.044771602    0.044771602    0.044771602    0.044771602    0.044771602   -1.8784313e-13 -8.4807144e-13 -1.7611311e-12
Loop time of 6.204e-06 on 1 procs for 0 steps with 8 atoms

177.3% CPU use with 1 MPI tasks x 1 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   |            | 6.204e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         5248 ave        5248 max        5248 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5248
Ave neighs/atom = 656
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.044615241178585 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.583143 2.583143 2.583143
Created orthogonal box = (0 0 0) to (2.583143 2.583143 2.583143)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.583143 2.583143 2.583143)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.583143       0              2.583143       0              2.583143      -59.511479      3463.269       3463.269       3463.269       3463.269       3463.269      -1.2804992e-12 -2.9115267e-11 -2.2022012e-11
Loop time of 6.786e-06 on 1 procs for 0 steps with 8 atoms

221.0% CPU use with 1 MPI tasks x 1 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   |            | 6.786e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         5248 ave        5248 max        5248 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5248
Ave neighs/atom = 656
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0445843960625973 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.564061 2.564061 2.564061
Created orthogonal box = (0 0 0) to (2.564061 2.564061 2.564061)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.564061 2.564061 2.564061)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.154 | 5.154 | 5.154 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.564061       0              2.564061       0              2.564061      -59.507078      48756.932      48756.932      48756.932      48756.932      48756.932     -5.3875253e-11 -1.9256596e-11 -5.2553352e-11
Loop time of 6.225e-06 on 1 procs for 0 steps with 8 atoms

192.8% CPU use with 1 MPI tasks x 1 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   |            | 6.225e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           1954 ave        1954 max        1954 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:         5248 ave        5248 max        5248 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5248
Ave neighs/atom = 656
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0440342804741851 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.544379 2.544379 2.544379
Created orthogonal box = (0 0 0) to (2.544379 2.544379 2.544379)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.544379 2.544379 2.544379)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.544379       0              2.544379       0              2.544379      -59.493718      24748.724      24748.724      24748.724      24748.724      24748.724     -1.1640141e-11  1.2191219e-10  1.1250807e-10
Loop time of 6.114e-06 on 1 procs for 0 steps with 8 atoms

179.9% CPU use with 1 MPI tasks x 1 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   |            | 6.114e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         5632 ave        5632 max        5632 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5632
Ave neighs/atom = 704
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0423642159659225 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.524057 2.524057 2.524057
Created orthogonal box = (0 0 0) to (2.524057 2.524057 2.524057)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.524057 2.524057 2.524057)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.524057       0              2.524057       0              2.524057      -59.491995      602.40446      602.40446      602.40446      602.40446      602.40446      1.9106873e-13 -3.1556089e-13  2.3242194e-13
Loop time of 6.235e-06 on 1 procs for 0 steps with 8 atoms

304.7% CPU use with 1 MPI tasks x 1 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   |            | 6.235e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         5824 ave        5824 max        5824 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5824
Ave neighs/atom = 728
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.04214889656091 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.503053 2.503053 2.503053
Created orthogonal box = (0 0 0) to (2.503053 2.503053 2.503053)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.503053 2.503053 2.503053)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.503053       0              2.503053       0              2.503053      -59.491961      6.4492296      6.4492296      6.4492296      6.4492296      6.4492296      5.3782921e-15  4.3138564e-14  4.3172537e-14
Loop time of 6.085e-06 on 1 procs for 0 steps with 8 atoms

180.8% CPU use with 1 MPI tasks x 1 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   |            | 6.085e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         5824 ave        5824 max        5824 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5824
Ave neighs/atom = 728
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0421446438555471 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.481318 2.481318 2.481318
Created orthogonal box = (0 0 0) to (2.481318 2.481318 2.481318)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.481318 2.481318 2.481318)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.481318       0              2.481318       0              2.481318      -59.491961      0.075781842    0.075781842    0.075781842    0.075781842    0.075781842   -7.4246121e-17 -3.1561921e-16  1.1861813e-16
Loop time of 8.61e-06 on 1 procs for 0 steps with 8 atoms

162.6% CPU use with 1 MPI tasks x 1 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   |            | 8.61e-06   |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         5824 ave        5824 max        5824 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5824
Ave neighs/atom = 728
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.04214460335821 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.458802 2.458802 2.458802
Created orthogonal box = (0 0 0) to (2.458802 2.458802 2.458802)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.458802 2.458802 2.458802)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.458802       0              2.458802       0              2.458802      -59.491961      0.11440746     0.11440746     0.11440746     0.11440746     0.11440746     1.626166e-15   6.2921434e-16  5.6735272e-16
Loop time of 6.244e-06 on 1 procs for 0 steps with 8 atoms

192.2% CPU use with 1 MPI tasks x 1 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   |            | 6.244e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         5920 ave        5920 max        5920 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5920
Ave neighs/atom = 740
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0421446007570472 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.435445 2.435445 2.435445
Created orthogonal box = (0 0 0) to (2.435445 2.435445 2.435445)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.435445 2.435445 2.435445)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.435445       0              2.435445       0              2.435445      -59.491961      0.29069711     0.29069711     0.29069711     0.29069711     0.29069711    -1.8113166e-15  1.874872e-15  -2.3325807e-16
Loop time of 6.104e-06 on 1 procs for 0 steps with 8 atoms

180.2% CPU use with 1 MPI tasks x 1 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   |            | 6.104e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         6400 ave        6400 max        6400 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 6400
Ave neighs/atom = 800
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0421445946545971 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.411182 2.411182 2.411182
Created orthogonal box = (0 0 0) to (2.411182 2.411182 2.411182)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.411182 2.411182 2.411182)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.411182       0              2.411182       0              2.411182      -59.491961      0.8800697      0.8800697      0.8800697      0.8800697      0.8800697     -1.6354668e-15  3.5484117e-14  2.8001377e-14
Loop time of 8.109e-06 on 1 procs for 0 steps with 8 atoms

172.6% CPU use with 1 MPI tasks x 1 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   |            | 8.109e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         6400 ave        6400 max        6400 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 6400
Ave neighs/atom = 800
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0421445771016344 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.385939 2.385939 2.385939
Created orthogonal box = (0 0 0) to (2.385939 2.385939 2.385939)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.385939 2.385939 2.385939)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.385939       0              2.385939       0              2.385939      -59.49196       3.1147926      3.1147926      3.1147926      3.1147926      3.1147926      5.0614591e-14  4.9744625e-14  3.1930012e-14
Loop time of 6.054e-06 on 1 procs for 0 steps with 8 atoms

198.2% CPU use with 1 MPI tasks x 1 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   |            | 6.054e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         6784 ave        6784 max        6784 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 6784
Ave neighs/atom = 848
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.04214451763601 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.359635 2.359635 2.359635
Created orthogonal box = (0 0 0) to (2.359635 2.359635 2.359635)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.359635 2.359635 2.359635)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.165 | 5.165 | 5.165 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.359635       0              2.359635       0              2.359635      -59.491958      12.73847       12.73847       12.73847       12.73847       12.73847       1.725579e-13   2.3299311e-14 -4.7870432e-14
Loop time of 6.215e-06 on 1 procs for 0 steps with 8 atoms

193.1% CPU use with 1 MPI tasks x 1 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   |            | 6.215e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           2462 ave        2462 max        2462 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:         7072 ave        7072 max        7072 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 7072
Ave neighs/atom = 884
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0421442826922602 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.332176 2.332176 2.332176
Created orthogonal box = (0 0 0) to (2.332176 2.332176 2.332176)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.332176 2.332176 2.332176)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.211 | 5.211 | 5.211 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.332176       0              2.332176       0              2.332176      -59.491949      73.542872      73.542872      73.542872      73.542872      73.542872      1.6487202e-13  1.9983569e-12  2.1791832e-12
Loop time of 6.575e-06 on 1 procs for 0 steps with 8 atoms

228.1% CPU use with 1 MPI tasks x 1 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   |            | 6.575e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3052 ave        3052 max        3052 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:         7312 ave        7312 max        7312 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 7312
Ave neighs/atom = 914
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0421430891818098 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.303457 2.303457 2.303457
Created orthogonal box = (0 0 0) to (2.303457 2.303457 2.303457)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.303457 2.303457 2.303457)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.211 | 5.211 | 5.211 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.303457       0              2.303457       0              2.303457      -59.491879      595.62334      595.62334      595.62334      595.62334      595.62334     -3.673035e-12  -3.824195e-11  -3.2413596e-11
Loop time of 6.175e-06 on 1 procs for 0 steps with 8 atoms

178.1% CPU use with 1 MPI tasks x 1 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   |            | 6.175e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3052 ave        3052 max        3052 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:         7536 ave        7536 max        7536 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 7536
Ave neighs/atom = 942
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0421343190695849 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.273355 2.273355 2.273355
Created orthogonal box = (0 0 0) to (2.273355 2.273355 2.273355)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.273355 2.273355 2.273355)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.211 | 5.211 | 5.211 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.273355       0              2.273355       0              2.273355      -59.4912        5313.0217      5313.0217      5313.0217      5313.0217      5313.0217      7.5322937e-11 -2.0886909e-10 -1.9928854e-10
Loop time of 6.535e-06 on 1 procs for 0 steps with 8 atoms

290.7% CPU use with 1 MPI tasks x 1 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   |            | 6.535e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3052 ave        3052 max        3052 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:         7536 ave        7536 max        7536 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 7536
Ave neighs/atom = 942
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0420494659196349 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.241731 2.241731 2.241731
Created orthogonal box = (0 0 0) to (2.241731 2.241731 2.241731)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.241731 2.241731 2.241731)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.211 | 5.211 | 5.211 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.241731       0              2.241731       0              2.241731      -59.489688      1234.7081      1234.7081      1234.7081      1234.7081      1234.7081     -9.4869043e-12 -3.1595681e-11 -2.8714171e-11
Loop time of 6.435e-06 on 1 procs for 0 steps with 8 atoms

0.0% CPU use with 1 MPI tasks x 1 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   |            | 6.435e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3052 ave        3052 max        3052 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:         8496 ave        8496 max        8496 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 8496
Ave neighs/atom = 1062
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0418604534419975 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.208423 2.208423 2.208423
Created orthogonal box = (0 0 0) to (2.208423 2.208423 2.208423)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.208423 2.208423 2.208423)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.211 | 5.211 | 5.211 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.208423       0              2.208423       0              2.208423      -59.48962       3.2416031      3.2416031      3.2416031      3.2416031      3.2416031      5.6458115e-14  3.9703018e-14  3.6715885e-14
Loop time of 8.39e-06 on 1 procs for 0 steps with 8 atoms

190.7% CPU use with 1 MPI tasks x 1 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   |            | 8.39e-06   |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3052 ave        3052 max        3052 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:         8688 ave        8688 max        8688 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 8688
Ave neighs/atom = 1086
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0418519583282597 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.173241 2.173241 2.173241
Created orthogonal box = (0 0 0) to (2.173241 2.173241 2.173241)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.173241 2.173241 2.173241)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.211 | 5.211 | 5.211 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.173241       0              2.173241       0              2.173241      -59.48962       0.28008919     0.28008919     0.28008919     0.28008919     0.28008919     2.2187628e-15  9.2265651e-15  1.0368996e-14
Loop time of 6.044e-06 on 1 procs for 0 steps with 8 atoms

182.0% CPU use with 1 MPI tasks x 1 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   |            | 6.044e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3052 ave        3052 max        3052 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:         8784 ave        8784 max        8784 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 8784
Ave neighs/atom = 1098
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0418519327441222 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.135963 2.135963 2.135963
Created orthogonal box = (0 0 0) to (2.135963 2.135963 2.135963)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.135963 2.135963 2.135963)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.225 | 5.225 | 5.225 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.135963       0              2.135963       0              2.135963      -59.489218      14730.54       14730.54       14730.54       14730.54       14730.54       7.2069565e-12 -3.1395879e-10 -2.5409181e-10
Loop time of 6.244e-06 on 1 procs for 0 steps with 8 atoms

192.2% CPU use with 1 MPI tasks x 1 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   |            | 6.244e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3728 ave        3728 max        3728 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:         9648 ave        9648 max        9648 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 9648
Ave neighs/atom = 1206
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0418017393337351 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.096321 2.096321 2.096321
Created orthogonal box = (0 0 0) to (2.096321 2.096321 2.096321)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.096321 2.096321 2.096321)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.225 | 5.225 | 5.225 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.096321       0              2.096321       0              2.096321      -59.44871       9824.1282      9824.1282      9824.1282      9824.1282      9824.1282      3.4506574e-12 -1.2657267e-11 -3.4196156e-11
Loop time of 6.165e-06 on 1 procs for 0 steps with 8 atoms

178.4% CPU use with 1 MPI tasks x 1 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   |            | 6.165e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3728 ave        3728 max        3728 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:         9840 ave        9840 max        9840 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 9840
Ave neighs/atom = 1230
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0367382536619596 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.053996 2.053996 2.053996
Created orthogonal box = (0 0 0) to (2.053996 2.053996 2.053996)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.053996 2.053996 2.053996)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.225 | 5.225 | 5.225 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.053996       0              2.053996       0              2.053996      -59.443689     -50.465938     -50.465938     -50.465938     -50.465938     -50.465938     -2.6556496e-13  6.7827214e-13  9.6815401e-13
Loop time of 6.184e-06 on 1 procs for 0 steps with 8 atoms

194.0% CPU use with 1 MPI tasks x 1 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   |            | 6.184e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3728 ave        3728 max        3728 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:        10704 ave       10704 max       10704 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 10704
Ave neighs/atom = 1338
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0361106465844721 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 2.008598 2.008598 2.008598
Created orthogonal box = (0 0 0) to (2.008598 2.008598 2.008598)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (2.008598 2.008598 2.008598)
  create_atoms CPU = 0.001 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      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) = 5.225 | 5.225 | 5.225 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              2.008598       0              2.008598       0              2.008598      -59.44369      -1.407327e-07  -1.407327e-07  -1.407327e-07  -1.407327e-07  -1.407327e-07  -3.1568592e-22  1.4412975e-21  1.7074497e-21
Loop time of 6.234e-06 on 1 procs for 0 steps with 8 atoms

192.5% CPU use with 1 MPI tasks x 1 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   |            | 6.234e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           3728 ave        3728 max        3728 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:        10960 ave       10960 max       10960 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 10960
Ave neighs/atom = 1370
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0361107753652847 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 1.959646 1.959646 1.959646
Created orthogonal box = (0 0 0) to (1.959646 1.959646 1.959646)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (1.959646 1.959646 1.959646)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:970)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 5.24 | 5.24 | 5.24 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              1.959646       0              1.959646       0              1.959646      -59.440027      10580.77       10580.77       10580.77       10580.77       10580.77      -1.1323064e-11 -1.0097626e-10 -1.1979448e-10
Loop time of 6.134e-06 on 1 procs for 0 steps with 8 atoms

179.3% CPU use with 1 MPI tasks x 1 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   |            | 6.134e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           4496 ave        4496 max        4496 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:        12400 ave       12400 max       12400 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 12400
Ave neighs/atom = 1550
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0356528097607978 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 1.906536 1.906536 1.906536
Created orthogonal box = (0 0 0) to (1.906536 1.906536 1.906536)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (1.906536 1.906536 1.906536)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:970)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 5.24 | 5.24 | 5.24 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              1.906536       0              1.906536       0              1.906536      -59.439972      0              0              0              0              0              0              0              0            
Loop time of 6.264e-06 on 1 procs for 0 steps with 8 atoms

223.5% CPU use with 1 MPI tasks x 1 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   |            | 6.264e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           4496 ave        4496 max        4496 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:        12880 ave       12880 max       12880 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 12880
Ave neighs/atom = 1610
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0356459174714345 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 1.848494 1.848494 1.848494
Created orthogonal box = (0 0 0) to (1.848494 1.848494 1.848494)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (1.848494 1.848494 1.848494)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:970)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 5.256 | 5.256 | 5.256 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              1.848494       0              1.848494       0              1.848494      -59.416584      0              0              0              0              0              0              0              0            
Loop time of 5.903e-06 on 1 procs for 0 steps with 8 atoms

186.3% CPU use with 1 MPI tasks x 1 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   |            | 5.903e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           5364 ave        5364 max        5364 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:        14896 ave       14896 max       14896 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 14896
Ave neighs/atom = 1862
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0327224977461222 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 1.784512 1.784512 1.784512
Created orthogonal box = (0 0 0) to (1.784512 1.784512 1.784512)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (1.784512 1.784512 1.784512)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:970)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 5.256 | 5.256 | 5.256 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              1.784512       0              1.784512       0              1.784512      -59.413279      0              0              0              0              0              0              0              0            
Loop time of 6.054e-06 on 1 procs for 0 steps with 8 atoms

280.8% CPU use with 1 MPI tasks x 1 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   |            | 6.054e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           5364 ave        5364 max        5364 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:        15696 ave       15696 max       15696 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 15696
Ave neighs/atom = 1962
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0323092933227977 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 1.713232 1.713232 1.713232
Created orthogonal box = (0 0 0) to (1.713232 1.713232 1.713232)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (1.713232 1.713232 1.713232)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:970)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 5.313 | 5.313 | 5.313 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              1.713232       0              1.713232       0              1.713232      -59.413279      0              0              0              0              0              0              0              0            
Loop time of 6.445e-06 on 1 procs for 0 steps with 8 atoms

217.2% CPU use with 1 MPI tasks x 1 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   |            | 6.445e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           6338 ave        6338 max        6338 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:        18528 ave       18528 max       18528 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 18528
Ave neighs/atom = 2316
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0323092933227977 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 1.632774 1.632774 1.632774
Created orthogonal box = (0 0 0) to (1.632774 1.632774 1.632774)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (1.632774 1.632774 1.632774)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:970)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 5.332 | 5.332 | 5.332 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              1.632774       0              1.632774       0              1.632774      -59.413279      0.079386069    0.079386069    0.079386069    0.079386069    0.079386069    5.0028833e-16  5.8793171e-15  5.6923573e-15
Loop time of 6.254e-06 on 1 procs for 0 steps with 8 atoms

207.9% CPU use with 1 MPI tasks x 1 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   |            | 6.254e-06  |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           7422 ave        7422 max        7422 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:        20736 ave       20736 max       20736 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 20736
Ave neighs/atom = 2592
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.032309293250135 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 1.540417 1.540417 1.540417
Created orthogonal box = (0 0 0) to (1.540417 1.540417 1.540417)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (1.540417 1.540417 1.540417)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mixed pair_coeff terms from geometric mixing rule
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 7
  ghost atom cutoff = 7
  binsize = 3.5, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair kim, perpetual
      attributes: full, newton off, cut 7
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:970)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 5.352 | 5.352 | 5.352 Mbytes
   Step        Atoms     v_xlo_metal    v_xhi_metal    v_ylo_metal    v_yhi_metal    v_zlo_metal    v_zhi_metal     v_pe_metal       Press      v_press_metal   v_pxx_metal    v_pyy_metal    v_pzz_metal    v_pxy_metal    v_pxz_metal    v_pyz_metal  
         0           8   0              1.540417       0              1.540417       0              1.540417      -59.409538      0              0              0              0              0              0              0              0            
Loop time of 8.41e-06 on 1 procs for 0 steps with 8 atoms

190.2% CPU use with 1 MPI tasks x 1 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   |            | 8.41e-06   |            |       |100.00

Nlocal:              8 ave           8 max           8 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:           8622 ave        8622 max        8622 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:        24864 ave       24864 max       24864 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 24864
Ave neighs/atom = 3108
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0318417438298226 eV/atom
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98)
  using 1 OpenMP thread(s) per MPI task

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

Lattice spacing in x,y,z = 1.432024 1.432024 1.432024
Created orthogonal box = (0 0 0) to (1.432024 1.432024 1.432024)
  1 by 1 by 1 MPI processor grid
Created 8 atoms
  using lattice units in orthogonal box = (0 0 0) to (1.432024 1.432024 1.432024)
  create_atoms CPU = 0.000 seconds

WARNING: 'kim_<command>' has been renamed to 'kim <command>'. Please update your input.

WARNING: No fixes with time integration, atoms won't move (src/verlet.cpp:60)
Generated 0 of 0 mi