LAMMPS (30 Jul 2021)
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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 3.2837500 3.2837500 3.2837500
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (3.2837500 3.2837500 3.2837500)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (3.2837500 3.2837500 3.2837500)
  create_atoms CPU = 0.001 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXphJEsF/CH.airebo-m with DATE: 2016-03-15

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/SM_460187474631_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

Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.849 | 5.849 | 5.849 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        2            0      3.28375            0      3.28375            0      3.28375 -0.018340349   -2384.2287   -2384.2287   -2384.2287   -2384.2287   -2384.2287 -8.7975139e-14 -6.2089108e-14 -1.0422442e-13 
Loop time of 9.491e-06 on 1 procs for 0 steps with 2 atoms

126.4% 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   |            | 9.491e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        1239.00 ave        1239 max        1239 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      820.000 ave         820 max         820 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 820
Ave neighs/atom = 410.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.00917017443330045 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 3.0637270 3.0637270 3.0637270
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (3.0637270 3.0637270 3.0637270)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (3.0637270 3.0637270 3.0637270)
  create_atoms CPU = 0.001 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXeDDJSC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.849 | 5.849 | 5.849 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        2            0     3.063727            0     3.063727            0     3.063727 -0.032358917   -4645.6488   -4645.6488   -4645.6488   -4645.6488   -4645.6488 1.0736961e-13 -1.6535886e-13 -1.1062119e-13 
Loop time of 8.609e-06 on 1 procs for 0 steps with 2 atoms

174.2% 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   |            | 8.609e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        1239.00 ave        1239 max        1239 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1060.00 ave        1060 max        1060 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1060
Ave neighs/atom = 530.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0161794582819088 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.9273660 2.9273660 2.9273660
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.9273660 2.9273660 2.9273660)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.9273660 2.9273660 2.9273660)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXP3wrAC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.903 | 5.903 | 5.903 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        2            0     2.927366            0     2.927366            0     2.927366 -0.045317023   -6799.9117   -6799.9117   -6799.9117   -6799.9117   -6799.9117 -9.924072e-14 6.4862922e-13 2.6312493e-13 
Loop time of 6.445e-06 on 1 procs for 0 steps with 2 atoms

124.1% 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   |            | 6.445e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        1727.00 ave        1727 max        1727 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1216.00 ave        1216 max        1216 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1216
Ave neighs/atom = 608.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0226585114014223 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.8282920 2.8282920 2.8282920
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.8282920 2.8282920 2.8282920)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.8282920 2.8282920 2.8282920)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX3HB4kD/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.903 | 5.903 | 5.903 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        2            0     2.828292            0     2.828292            0     2.828292 -0.057186039   -8706.4329   -8706.4329   -8706.4329   -8706.4329   -8706.4329 -8.422177e-14 1.1930127e-12 6.7317901e-13 
Loop time of 6.485e-06 on 1 procs for 0 steps with 2 atoms

138.8% 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   |            | 6.485e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        1727.00 ave        1727 max        1727 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1288.00 ave        1288 max        1288 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1288
Ave neighs/atom = 644.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0285930193753078 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.7504320 2.7504320 2.7504320
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.7504320 2.7504320 2.7504320)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.7504320 2.7504320 2.7504320)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXxrYdiD/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.903 | 5.903 | 5.903 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        2            0     2.750432            0     2.750432            0     2.750432 -0.067947814   -10273.911   -10273.911   -10273.911   -10273.911   -10273.911 1.410063e-14 1.494842e-12 1.9494579e-12 
Loop time of 6.676e-06 on 1 procs for 0 steps with 2 atoms

149.8% 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   |            | 6.676e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        1727.00 ave        1727 max        1727 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1448.00 ave        1448 max        1448 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1448
Ave neighs/atom = 724.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0339739070485515 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.6862840 2.6862840 2.6862840
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.6862840 2.6862840 2.6862840)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.6862840 2.6862840 2.6862840)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX4eX0XE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.913 | 5.913 | 5.913 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        2            0     2.686284            0     2.686284            0     2.686284 -0.077591742   -11423.465   -11423.465   -11423.465   -11423.465   -11423.465 3.4375593e-13 1.0402311e-12 6.7865132e-14 
Loop time of 6.606e-06 on 1 procs for 0 steps with 2 atoms

181.7% 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   |            | 6.606e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        2329.00 ave        2329 max        2329 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1496.00 ave        1496 max        1496 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1496
Ave neighs/atom = 748.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0387958711331067 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.6317350 2.6317350 2.6317350
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.6317350 2.6317350 2.6317350)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.6317350 2.6317350 2.6317350)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXhFQdNE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.913 | 5.913 | 5.913 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        2            0     2.631735            0     2.631735            0     2.631735 -0.086105864   -12091.271   -12091.271   -12091.271   -12091.271   -12091.271 9.6548243e-14 1.6737867e-12 1.3793494e-12 
Loop time of 6.535e-06 on 1 procs for 0 steps with 2 atoms

122.4% 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   |            | 6.535e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        2329.00 ave        2329 max        2329 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1736.00 ave        1736 max        1736 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1736
Ave neighs/atom = 868.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0430529319422851 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.5842810 2.5842810 2.5842810
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.5842810 2.5842810 2.5842810)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.5842810 2.5842810 2.5842810)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXkGG2vE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.913 | 5.913 | 5.913 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        2            0     2.584281            0     2.584281            0     2.584281  -0.09270216   -7288.4832   -7288.4832   -7288.4832   -7288.4832   -7288.4832 3.8197075e-13 -6.1546904e-12 -5.2712169e-12 
Loop time of 6.585e-06 on 1 procs for 0 steps with 2 atoms

136.7% 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   |            | 6.585e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        2329.00 ave        2329 max        2329 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1784.00 ave        1784 max        1784 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1784
Ave neighs/atom = 892.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0463510798812697 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.5422880 2.5422880 2.5422880
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.5422880 2.5422880 2.5422880)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.5422880 2.5422880 2.5422880)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXkXua4D/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.913 | 5.913 | 5.913 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        2            0     2.542288            0     2.542288            0     2.542288 -0.094714301   -1027.5062   -1027.5062   -1027.5062   -1027.5062   -1027.5062 -5.1280156e-13 6.4854721e-12 7.0264891e-12 
Loop time of 6.675e-06 on 1 procs for 0 steps with 2 atoms

134.8% 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   |            | 6.675e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        2329.00 ave        2329 max        2329 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1880.00 ave        1880 max        1880 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1880
Ave neighs/atom = 940.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0473571503996549 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.5046270 2.5046270 2.5046270
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.5046270 2.5046270 2.5046270)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.5046270 2.5046270 2.5046270)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXUIfo7B/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.913 | 5.913 | 5.913 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        2            0     2.504627            0     2.504627            0     2.504627 -0.094538635    1210.2504    1210.2504    1210.2504    1210.2504    1210.2504 -2.4944021e-12 -1.4457013e-11 -1.3528528e-11 
Loop time of 6.676e-06 on 1 procs for 0 steps with 2 atoms

179.7% 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   |            | 6.676e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        2329.00 ave        2329 max        2329 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1880.00 ave        1880 max        1880 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1880
Ave neighs/atom = 940.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0472693176466883 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.4704880 2.4704880 2.4704880
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.4704880 2.4704880 2.4704880)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.4704880 2.4704880 2.4704880)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXlXAndD/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.913 | 5.913 | 5.913 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        2            0     2.470488            0     2.470488            0     2.470488 -0.094218691   -169.22902   -169.22902   -169.22902   -169.22902   -169.22902 6.5398676e-13 1.0130022e-11 1.225335e-11 
Loop time of 6.555e-06 on 1 procs for 0 steps with 2 atoms

167.8% 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   |            | 6.555e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        2329.00 ave        2329 max        2329 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      1928.00 ave        1928 max        1928 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 1928
Ave neighs/atom = 964.00000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0471093455599887 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.4392680 2.4392680 2.4392680
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.4392680 2.4392680 2.4392680)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.4392680 2.4392680 2.4392680)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXpPmNpE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 5.972 | 5.972 | 5.972 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        2            0     2.439268            0     2.439268            0     2.439268  -0.09493818     -4382.84     -4382.84     -4382.84     -4382.84     -4382.84 2.0566186e-13 4.925369e-12 3.2432049e-12 
Loop time of 6.495e-06 on 1 procs for 0 steps with 2 atoms

184.8% 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   |            | 6.495e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2132.00 ave        2132 max        2132 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2132
Ave neighs/atom = 1066.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0474690897756012 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.4105070 2.4105070 2.4105070
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.4105070 2.4105070 2.4105070)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.4105070 2.4105070 2.4105070)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXtpOg4D/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.410507            0     2.410507            0     2.410507 -0.097222845    -10331.42    -10331.42    -10331.42    -10331.42    -10331.42 4.8680386e-15 4.3884032e-12 4.6160481e-12 
Loop time of 6.616e-06 on 1 procs for 0 steps with 2 atoms

136.0% 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   |            | 6.616e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2132.00 ave        2132 max        2132 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2132
Ave neighs/atom = 1066.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0486114223415553 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.3838460 2.3838460 2.3838460
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.3838460 2.3838460 2.3838460)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.3838460 2.3838460 2.3838460)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX6daMWE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.383846            0     2.383846            0     2.383846  -0.10108837   -16656.391   -16656.391   -16656.391   -16656.391   -16656.391 1.1550403e-12 -5.4575219e-12 -5.5973997e-12 
Loop time of 6.365e-06 on 1 procs for 0 steps with 2 atoms

188.5% 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   |            | 6.365e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2276.00 ave        2276 max        2276 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2276
Ave neighs/atom = 1138.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0505441864974655 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.3589980 2.3589980 2.3589980
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.3589980 2.3589980 2.3589980)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.3589980 2.3589980 2.3589980)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXIBppmG/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.358998            0     2.358998            0     2.358998  -0.10615205   -21784.794   -21784.794   -21784.794   -21784.794   -21784.794 3.6467915e-12 5.2319584e-13 -1.8396107e-13 
Loop time of 6.424e-06 on 1 procs for 0 steps with 2 atoms

140.1% 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   |            | 6.424e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2276.00 ave        2276 max        2276 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2276
Ave neighs/atom = 1138.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.053076022745195 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.3357340 2.3357340 2.3357340
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.3357340 2.3357340 2.3357340)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.3357340 2.3357340 2.3357340)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX6HcCJF/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.335734            0     2.335734            0     2.335734  -0.11171629   -23999.598   -23999.598   -23999.598   -23999.598   -23999.598 -2.5611715e-13 -5.578478e-12 -7.2008983e-12 
Loop time of 6.946e-06 on 1 procs for 0 steps with 2 atoms

129.6% 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   |            | 6.946e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2484.00 ave        2484 max        2484 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2484
Ave neighs/atom = 1242.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0558581439294185 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.3138620 2.3138620 2.3138620
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.3138620 2.3138620 2.3138620)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.3138620 2.3138620 2.3138620)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXujbG9E/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.313862            0     2.313862            0     2.313862   -0.1170952   -24572.606   -24572.606   -24572.606   -24572.606   -24572.606 -1.4985088e-12 -4.0810245e-13 9.1136311e-13 
Loop time of 6.505e-06 on 1 procs for 0 steps with 2 atoms

153.7% 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   |            | 6.505e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2484.00 ave        2484 max        2484 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2484
Ave neighs/atom = 1242.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.0585475990634105 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.2932260 2.2932260 2.2932260
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2932260 2.2932260 2.2932260)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2932260 2.2932260 2.2932260)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXWNqutG/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.293226            0     2.293226            0     2.293226  -0.25130864   -1651903.2   -1651903.2   -1651903.2   -1651903.2   -1651903.2  0.021308043  0.021308042  0.021308042 
Loop time of 6.515e-06 on 1 procs for 0 steps with 2 atoms

184.2% 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   |            | 6.515e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2484.00 ave        2484 max        2484 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2484
Ave neighs/atom = 1242.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.125654320427166 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.2736930 2.2736930 2.2736930
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2736930 2.2736930 2.2736930)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2736930 2.2736930 2.2736930)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXrmfgiC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.273693            0     2.273693            0     2.273693  -0.75749357     -3665896     -3665896     -3665896     -3665896     -3665896    4.4943669    4.4943669    4.4943669 
Loop time of 6.365e-06 on 1 procs for 0 steps with 2 atoms

188.5% 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   |            | 6.365e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2580.00 ave        2580 max        2580 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2580
Ave neighs/atom = 1290.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.3787467825323 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.2551520 2.2551520 2.2551520
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2551520 2.2551520 2.2551520)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2551520 2.2551520 2.2551520)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXBGLyiE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.255152            0     2.255152            0     2.255152    -1.576676   -5460441.5   -5460441.5   -5460441.5   -5460441.5   -5460441.5     35.71255     35.71255     35.71255 
Loop time of 6.425e-06 on 1 procs for 0 steps with 2 atoms

202.3% 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   |            | 6.425e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2724.00 ave        2724 max        2724 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2724
Ave neighs/atom = 1362.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.788337995911835 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.2375060 2.2375060 2.2375060
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2375060 2.2375060 2.2375060)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2375060 2.2375060 2.2375060)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXBwUCjG/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.237506            0     2.237506            0     2.237506   -2.5350157   -6019861.5   -6019861.5   -6019861.5   -6019861.5   -6019861.5    140.29231    140.29231    140.29231 
Loop time of 7.136e-06 on 1 procs for 0 steps with 2 atoms

168.2% 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   |            | 7.136e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2724.00 ave        2724 max        2724 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2724
Ave neighs/atom = 1362.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -1.26750783062656 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.2206730 2.2206730 2.2206730
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2206730 2.2206730 2.2206730)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2206730 2.2206730 2.2206730)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXRZ2l7C/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.353 | 6.353 | 6.353 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        2            0     2.220673            0     2.220673            0     2.220673   -3.5791748   -7239748.4   -7239748.4   -7239748.4   -7239748.4   -7239748.4      378.136      378.136      378.136 
Loop time of 6.926e-06 on 1 procs for 0 steps with 2 atoms

187.7% 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   |            | 6.926e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3057.00 ave        3057 max        3057 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2820.00 ave        2820 max        2820 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2820
Ave neighs/atom = 1410.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -1.7895873871335 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.2045820 2.2045820 2.2045820
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2045820 2.2045820 2.2045820)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.2045820 2.2045820 2.2045820)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXCSvjdD/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0     2.204582            0     2.204582            0     2.204582   -4.7289447   -8091716.7   -8091716.7   -8091716.7   -8091716.7   -8091716.7    197.14663    197.14663    197.14663 
Loop time of 6.134e-06 on 1 procs for 0 steps with 2 atoms

146.7% 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   |            | 6.134e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2820.00 ave        2820 max        2820 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2820
Ave neighs/atom = 1410.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -2.36447233629357 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.1891700 2.1891700 2.1891700
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1891700 2.1891700 2.1891700)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1891700 2.1891700 2.1891700)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX8HYU8E/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0      2.18917            0      2.18917            0      2.18917   -5.7620716   -41220.027   -41220.027   -41220.027   -41220.027   -41220.027   -71.825511   -71.825511   -71.825511 
Loop time of 7.196e-06 on 1 procs for 0 steps with 2 atoms

139.0% 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   |            | 7.196e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2916.00 ave        2916 max        2916 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2916
Ave neighs/atom = 1458.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -2.88103580475784 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.1735890 2.1735890 2.1735890
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1735890 2.1735890 2.1735890)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1735890 2.1735890 2.1735890)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXqTpV8F/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0     2.173589            0     2.173589            0     2.173589   -3.6457868    1821912.3    1821912.3    1821912.3    1821912.3    1821912.3    -368739.7    -368739.7    -368739.7 
Loop time of 6.766e-06 on 1 procs for 0 steps with 2 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   |            | 6.766e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2916.00 ave        2916 max        2916 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2916
Ave neighs/atom = 1458.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -1.82289339808271 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.1575320 2.1575320 2.1575320
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1575320 2.1575320 2.1575320)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1575320 2.1575320 2.1575320)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXndIv2B/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0     2.157532            0     2.157532            0     2.157532  -0.88025594     14452267     14452267     14452267     14452267     14452267    -533100.9    -533100.9    -533100.9 
Loop time of 6.264e-06 on 1 procs for 0 steps with 2 atoms

207.5% 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:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2916.00 ave        2916 max        2916 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2916
Ave neighs/atom = 1458.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: -0.44012797042755 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.1409700 2.1409700 2.1409700
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1409700 2.1409700 2.1409700)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1409700 2.1409700 2.1409700)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXa28HeF/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0      2.14097            0      2.14097            0      2.14097    4.4204278     33931459     33931459     33931459     33931459     33931459    -695891.3    -695891.3    -695891.3 
Loop time of 6.374e-06 on 1 procs for 0 steps with 2 atoms

204.0% 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   |            | 6.374e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      2940.00 ave        2940 max        2940 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 2940
Ave neighs/atom = 1470.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 2.21021388889898 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.1238700 2.1238700 2.1238700
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1238700 2.1238700 2.1238700)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1238700 2.1238700 2.1238700)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXPAdQeE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0      2.12387            0      2.12387            0      2.12387    6.4399699   -4727536.6   -4727536.6   -4727536.6   -4727536.6   -4727536.6   -873016.53   -873016.53   -873016.53 
Loop time of 6.495e-06 on 1 procs for 0 steps with 2 atoms

138.6% 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   |            | 6.495e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3180.00 ave        3180 max        3180 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3180
Ave neighs/atom = 1590.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 3.21998495548715 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.1061960 2.1061960 2.1061960
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1061960 2.1061960 2.1061960)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.1061960 2.1061960 2.1061960)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXpaWqKD/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0     2.106196            0     2.106196            0     2.106196     5.788031   -4048355.5   -4048355.5   -4048355.5   -4048355.5   -4048355.5     -1057547     -1057547     -1057547 
Loop time of 6.876e-06 on 1 procs for 0 steps with 2 atoms

189.1% 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   |            | 6.876e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3276.00 ave        3276 max        3276 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3276
Ave neighs/atom = 1638.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 2.89401551565168 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.0879080 2.0879080 2.0879080
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0879080 2.0879080 2.0879080)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0879080 2.0879080 2.0879080)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXQo7Q5F/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0     2.087908            0     2.087908            0     2.087908    5.2420166   -3174530.4   -3174530.4   -3174530.4   -3174530.4   -3174530.4   -1216742.1   -1223185.2   -1223185.2 
Loop time of 6.515e-06 on 1 procs for 0 steps with 2 atoms

153.5% 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   |            | 6.515e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3372.00 ave        3372 max        3372 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3372
Ave neighs/atom = 1686.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 2.6210082967082 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.0689610 2.0689610 2.0689610
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0689610 2.0689610 2.0689610)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0689610 2.0689610 2.0689610)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXryqgLE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0     2.068961            0     2.068961            0     2.068961    4.8343641   -2118716.5   -2118716.5   -2118716.5   -2118716.5   -2118716.5   -1328831.7   -1328831.7   -1328831.7 
Loop time of 6.345e-06 on 1 procs for 0 steps with 2 atoms

157.6% 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   |            | 6.345e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3516.00 ave        3516 max        3516 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3516
Ave neighs/atom = 1758.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 2.41718206606483 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.0493070 2.0493070 2.0493070
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0493070 2.0493070 2.0493070)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0493070 2.0493070 2.0493070)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXK6LHVC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.748 | 6.748 | 6.748 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        2            0     2.049307            0     2.049307            0     2.049307    4.5981692    -880417.6    -880417.6    -880417.6    -880417.6    -880417.6   -1372419.2   -1372419.2   -1372419.2 
Loop time of 6.355e-06 on 1 procs for 0 steps with 2 atoms

204.6% 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   |            | 6.355e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        3923.00 ave        3923 max        3923 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3612.00 ave        3612 max        3612 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3612
Ave neighs/atom = 1806.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 2.29908461255526 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.0288910 2.0288910 2.0288910
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0288910 2.0288910 2.0288910)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0288910 2.0288910 2.0288910)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX1iE97E/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.819 | 6.819 | 6.819 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        2            0     2.028891            0     2.028891            0     2.028891      4.57112    578618.16    578618.16    578618.16    578618.16    578618.16   -1288525.1   -1288525.1   -1288525.1 
Loop time of 6.836e-06 on 1 procs for 0 steps with 2 atoms

248.7% 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   |            | 6.836e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        4939.00 ave        4939 max        4939 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3672.00 ave        3672 max        3672 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3672
Ave neighs/atom = 1836.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 2.28555998930021 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 2.0076510 2.0076510 2.0076510
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0076510 2.0076510 2.0076510)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (2.0076510 2.0076510 2.0076510)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXdqZ5xE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/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) = 6.819 | 6.819 | 6.819 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        2            0     2.007651            0     2.007651            0     2.007651    4.8045073    2365126.2    2365126.2    2365126.2    2365126.2    2365126.2   -1052263.7   -1052263.7   -1052263.7 
Loop time of 6.164e-06 on 1 procs for 0 steps with 2 atoms

178.5% 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   |            | 6.164e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        4939.00 ave        4939 max        4939 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3784.00 ave        3784 max        3784 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3784
Ave neighs/atom = 1892.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 2.40225366106046 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.9855170 1.9855170 1.9855170
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.9855170 1.9855170 1.9855170)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.9855170 1.9855170 1.9855170)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX2dCx4F/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 6.819 | 6.819 | 6.819 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        2            0     1.985517            0     1.985517            0     1.985517    5.5386697    7733169.7    7733169.7    7733169.7    7733169.7    7733169.7   -623130.08   -623130.08   -623130.08 
Loop time of 6.304e-06 on 1 procs for 0 steps with 2 atoms

158.6% 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   |            | 6.304e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        4939.00 ave        4939 max        4939 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3832.00 ave        3832 max        3832 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3832
Ave neighs/atom = 1916.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 2.76933483059075 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.9624120 1.9624120 1.9624120
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.9624120 1.9624120 1.9624120)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.9624120 1.9624120 1.9624120)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXT8fJCC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 6.819 | 6.819 | 6.819 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        2            0     1.962412            0     1.962412            0     1.962412    7.5393546     16169014     16169014     16169014     16169014     16169014 -7.9083005e-09 -1.0860605e-08 -1.2883635e-08 
Loop time of 6.324e-06 on 1 procs for 0 steps with 2 atoms

158.1% 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   |            | 6.324e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        4939.00 ave        4939 max        4939 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      3976.00 ave        3976 max        3976 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 3976
Ave neighs/atom = 1988.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 3.76967730732618 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.9382450 1.9382450 1.9382450
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.9382450 1.9382450 1.9382450)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.9382450 1.9382450 1.9382450)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXu1IkYC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 6.819 | 6.819 | 6.819 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        2            0     1.938245            0     1.938245            0     1.938245    10.921769     23188457     23188457     23188457     23188457     23188457 -4.2199931e-09 -9.1004165e-09 -7.9364841e-09 
Loop time of 6.345e-06 on 1 procs for 0 steps with 2 atoms

157.6% 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   |            | 6.345e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        4939.00 ave        4939 max        4939 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      4168.00 ave        4168 max        4168 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4168
Ave neighs/atom = 2084.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 5.46088467794385 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.9129160 1.9129160 1.9129160
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.9129160 1.9129160 1.9129160)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.9129160 1.9129160 1.9129160)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXvWH9wC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 6.819 | 6.819 | 6.819 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        2            0     1.912916            0     1.912916            0     1.912916    15.655489     30716082     30716082     30716082     30716082     30716082 -1.5203654e-08 -2.7371903e-08 -2.9820865e-08 
Loop time of 6.325e-06 on 1 procs for 0 steps with 2 atoms

158.1% 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   |            | 6.325e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        4939.00 ave        4939 max        4939 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      4216.00 ave        4216 max        4216 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4216
Ave neighs/atom = 2108.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 7.8277445982448 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.8863060 1.8863060 1.8863060
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.8863060 1.8863060 1.8863060)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.8863060 1.8863060 1.8863060)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXzrr8oC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 6.819 | 6.819 | 6.819 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        2            0     1.886306            0     1.886306            0     1.886306    21.908293     38939850     38939850     38939850     38939850     38939850 -2.3022079e-08 -2.1863151e-08 -1.9393712e-08 
Loop time of 6.415e-06 on 1 procs for 0 steps with 2 atoms

155.9% 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   |            | 6.415e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        4939.00 ave        4939 max        4939 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      4456.00 ave        4456 max        4456 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4456
Ave neighs/atom = 2228.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 10.9541462514463 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.8582790 1.8582790 1.8582790
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.8582790 1.8582790 1.8582790)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.8582790 1.8582790 1.8582790)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXU5mjHD/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 7.217 | 7.217 | 7.217 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        2            0     1.858279            0     1.858279            0     1.858279    29.893429     47948807     47948807     47948807     47948807     47948807 -1.8080726e-08 1.3163607e-10 -2.8895505e-09 
Loop time of 7.206e-06 on 1 procs for 0 steps with 2 atoms

277.5% 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   |            | 7.206e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        6117.00 ave        6117 max        6117 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      4840.00 ave        4840 max        4840 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4840
Ave neighs/atom = 2420.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 14.9467142848085 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.8286750 1.8286750 1.8286750
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.8286750 1.8286750 1.8286750)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.8286750 1.8286750 1.8286750)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXDdCB1F/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 7.599 | 7.599 | 7.599 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        2            0     1.828675            0     1.828675            0     1.828675    39.809019     57244239     57244239     57244239     57244239     57244239 2.8089123e-08 3.1014572e-08 3.1243407e-08 
Loop time of 6.566e-06 on 1 procs for 0 steps with 2 atoms

167.5% 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   |            | 6.566e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        6117.00 ave        6117 max        6117 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      4888.00 ave        4888 max        4888 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 4888
Ave neighs/atom = 2444.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 19.9045094080687 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.7973070 1.7973070 1.7973070
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.7973070 1.7973070 1.7973070)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.7973070 1.7973070 1.7973070)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXjMoBhE/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 7.599 | 7.599 | 7.599 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        2            0     1.797307            0     1.797307            0     1.797307    51.689382     65453224     65453224     65453224     65453224     65453224 -8.8749918e-09 -9.4096558e-09 -1.1902534e-08 
Loop time of 6.575e-06 on 1 procs for 0 steps with 2 atoms

167.3% 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   |            | 6.575e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        6117.00 ave        6117 max        6117 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      5368.00 ave        5368 max        5368 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5368
Ave neighs/atom = 2684.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 25.8446910763174 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.7639500 1.7639500 1.7639500
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.7639500 1.7639500 1.7639500)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.7639500 1.7639500 1.7639500)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX6FISUF/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 7.980 | 7.980 | 7.980 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        2            0      1.76395            0      1.76395            0      1.76395    65.224972     70510246     70510246     70510246     70510246     70510246 2.2201813e-09 -9.1651769e-09 2.3009531e-09 
Loop time of 6.766e-06 on 1 procs for 0 steps with 2 atoms

147.8% 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   |            | 6.766e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        6117.00 ave        6117 max        6117 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      5464.00 ave        5464 max        5464 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5464
Ave neighs/atom = 2732.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 32.6124860116756 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.7283350 1.7283350 1.7283350
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.7283350 1.7283350 1.7283350)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.7283350 1.7283350 1.7283350)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXD2jVIF/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 8.828 | 8.828 | 8.828 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        2            0     1.728335            0     1.728335            0     1.728335    79.657309     70496332     70496332     70496332     70496332     70496332 -1.175204e-08 6.1441763e-09 1.1088207e-08 
Loop time of 6.575e-06 on 1 procs for 0 steps with 2 atoms

167.3% 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   |            | 6.575e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        7469.00 ave        7469 max        7469 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      5780.00 ave        5780 max        5780 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 5780
Ave neighs/atom = 2890.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 39.8286544990982 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.6901350 1.6901350 1.6901350
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.6901350 1.6901350 1.6901350)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.6901350 1.6901350 1.6901350)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXX6z6DYB/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 8.828 | 8.828 | 8.828 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        2            0     1.690135            0     1.690135            0     1.690135     94.04865     70785441     70785441     70785441     70785441     70785441 1.4472982e-10 -1.0379931e-08 -1.5909061e-08 
Loop time of 6.465e-06 on 1 procs for 0 steps with 2 atoms

201.1% 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   |            | 6.465e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        7469.00 ave        7469 max        7469 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      6284.00 ave        6284 max        6284 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 6284
Ave neighs/atom = 3142.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 47.0243251116991 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.6489440 1.6489440 1.6489440
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.6489440 1.6489440 1.6489440)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.6489440 1.6489440 1.6489440)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXZ98qxC/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Per MPI rank memory allocation (min/avg/max) = 8.828 | 8.828 | 8.828 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        2            0     1.648944            0     1.648944            0     1.648944    111.23993     90075877     90075877     90075877     90075877     90075877 9.0449465e-10 5.4087056e-09 -8.5105102e-09 
Loop time of 6.525e-06 on 1 procs for 0 steps with 2 atoms

168.6% 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   |            | 6.525e-06  |            |       |100.00

Nlocal:        2.00000 ave           2 max           2 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:        7469.00 ave        7469 max        7469 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:      6764.00 ave        6764 max        6764 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 6764
Ave neighs/atom = 3382.0000
Neighbor list builds = 0
Dangerous builds = 0
Cohesive energy: 55.61996355041 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.

# Using KIM Simulator Model : Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000
# For Simulator             : LAMMPS 17 Nov 2016
# Running on                : LAMMPS 30 Jul 2021
#
Lattice spacing in x,y,z = 1.6042540 1.6042540 1.6042540
Created orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.6042540 1.6042540 1.6042540)
  1 by 1 by 1 MPI processor grid
Created 2 atoms
  using lattice units in orthogonal box = (0.0000000 0.0000000 0.0000000) to (1.6042540 1.6042540 1.6042540)
  create_atoms CPU = 0.000 seconds

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

Reading airebo/morse potential file /tmp/kim-shared-library-parameter-file-directory-XXXXXXgqBcaD/CH.airebo-m with DATE: 2016-03-15
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 4000, page size: 100000
  master list distance cutoff = 12.2
  ghost atom cutoff = 12.2
  binsize = 6.1, bins = 1 1 1
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair airebo/morse, perpetual
      attributes: full, newton on, ghost
      pair build: full/bin/ghost
      stencil: full/ghost/bin/3d
      bin: standard
WARNING: Proc sub-domain size < neighbor skin, could lead to lost atoms (src/domain.cpp:964)
Setting up Verlet run ...
  Unit style    : metal
  Current step  : 0
  Time step     : 0.001
Pe