LAMMPS (24 Dec 2020)
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:94)
  using 1 OpenMP thread(s) per MPI task
# Using KIM Simulator Model : Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000
# For Simulator             : LAMMPS 3 Mar 2020
# Running on                : LAMMPS 24 Dec 2020
#
Created orthogonal box = (-25.000000 -25.000000 -25.000000) to (25.000000 25.000000 25.000000)
  1 by 1 by 1 MPI processor grid
Scanning dump file ...
Reading snapshot from dump file ...
  orthogonal box = (-25.000000 -25.000000 -25.000000) to (25.000000 25.000000 25.000000)
  0 atoms before read
  5 atoms in snapshot
  0 atoms purged
  0 atoms replaced
  0 atoms trimmed
  5 atoms added
  5 atoms after read
5 atoms in group all
Changing box ...
  orthogonal box = (-25.000000 -25.000000 -25.000000) to (25.000000 25.000000 25.000000)
  orthogonal box = (-25.000000 -25.000000 -25.000000) to (25.000000 25.000000 25.000000)
  orthogonal box = (-25.000000 -25.000000 -25.000000) to (25.000000 25.000000 25.000000)
WARNING: Using 'neigh_modify every 1 delay 0 check yes' setting during minimization (src/min.cpp:188)
Neighbor list info ...
  update every 1 steps, delay 0 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 8.1961461
  ghost atom cutoff = 8.1961461
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair adp, perpetual
      attributes: half, newton on
      pair build: half/nsq/newton
      stencil: none
      bin: none
Setting up cg style minimization ...
  Unit style    : metal
  Current step  : 0
Per MPI rank memory allocation (min/avg/max) = 8.656 | 8.656 | 8.656 Mbytes
v_pe_metal 
  -9.0864378 
  -12.809519 
Loop time of 0.0013954 on 1 procs for 63 steps with 5 atoms

75.0% CPU use with 1 MPI tasks x 1 OpenMP threads

Minimization stats:
  Stopping criterion = energy tolerance
  Energy initial, next-to-last, final = 
       -9.086437825623   -12.809519489291   -12.809519490462
  Force two-norm initial, final = 9.9035606 0.00029462865
  Force max component initial, final = 5.0955221 0.00014406199
  Final line search alpha, max atom move = 1.0000000 0.00014406199
  Iterations, force evaluations = 63 123

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.0001494  | 0.0001494  | 0.0001494  |   0.0 | 10.71
Neigh   | 0          | 0          | 0          |   0.0 |  0.00
Comm    | 1.08e-05   | 1.08e-05   | 1.08e-05   |   0.0 |  0.77
Output  | 0.0011508  | 0.0011508  | 0.0011508  |   0.0 | 82.47
Modify  | 0          | 0          | 0          |   0.0 |  0.00
Other   |            | 8.44e-05   |            |       |  6.05

Nlocal:        5.00000 ave           5 max           5 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:         0.00000 ave           0 max           0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:        10.0000 ave          10 max          10 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 10
Ave neighs/atom = 2.0000000
Neighbor list builds = 0
Dangerous builds = 0
Total wall time: 0:00:00