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lammps-graphene/docs/midterm_pres/pres_multi.log
Adamo c39caee898 Init and final.
2020-12-23 17:12:07 -05:00

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LAMMPS (9 Sep 2013)
Reading data file ...
orthogonal box = (-30 -30 -1) to (30 30 1)
1 by 1 by 1 MPI processor grid
877 atoms
48 atoms in group boundaryatoms
1 atoms in group central
WARNING: Resetting reneighboring criteria during minimization (../min.cpp:173)
Setting up minimization ...
Memory usage per processor = 13.3397 Mbytes
Step Temp PotEng TotEng KinEng E_pair Press p2
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1304 0.0000000000 -6607.6874787765 -6607.6874787765 0.0000000000 -6607.6874787765 3640.5107431415 -3640.5107431415
1305 0.0000000000 -6607.6874790099 -6607.6874790099 0.0000000000 -6607.6874790099 3640.6194845023 -3640.6194845024
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1310 0.0000000000 -6607.6874801798 -6607.6874801798 0.0000000000 -6607.6874801798 3640.7240083923 -3640.7240083923
1311 0.0000000000 -6607.6874805478 -6607.6874805478 0.0000000000 -6607.6874805478 3640.6365735355 -3640.6365735355
1312 0.0000000000 -6607.6874812102 -6607.6874812102 0.0000000000 -6607.6874812102 3640.5557709057 -3640.5557709057
1313 0.0000000000 -6607.6874833050 -6607.6874833050 0.0000000000 -6607.6874833050 3640.9194407460 -3640.9194407460
1314 0.0000000000 -6607.6874838706 -6607.6874838706 0.0000000000 -6607.6874838706 3641.2958293217 -3641.2958293218
1315 0.0000000000 -6607.6874875761 -6607.6874875761 0.0000000000 -6607.6874875761 3641.5516357016 -3641.5516357016
1316 0.0000000000 -6607.6874907865 -6607.6874907865 0.0000000000 -6607.6874907865 3641.0418560430 -3641.0418560430
1317 0.0000000000 -6607.6874914930 -6607.6874914930 0.0000000000 -6607.6874914930 3640.9930649997 -3640.9930649997
1318 0.0000000000 -6607.6874925760 -6607.6874925760 0.0000000000 -6607.6874925760 3641.2716513853 -3641.2716513853
1319 0.0000000000 -6607.6874926540 -6607.6874926540 0.0000000000 -6607.6874926540 3641.3006256975 -3641.3006256975
1320 0.0000000000 -6607.6874930379 -6607.6874930379 0.0000000000 -6607.6874930379 3641.1669016033 -3641.1669016033
1321 0.0000000000 -6607.6874931132 -6607.6874931132 0.0000000000 -6607.6874931132 3641.1374084319 -3641.1374084319
1322 0.0000000000 -6607.6874931132 -6607.6874931132 0.0000000000 -6607.6874931132 3641.1374084319 -3641.1374084319
Loop time of 1614.67 on 1 procs for 1322 steps with 877 atoms
Minimization stats:
Stopping criterion = linesearch alpha is zero
Energy initial, next-to-last, final =
-3972.29966639 -6607.68749311 -6607.68749311
Force two-norm initial, final = 11610.9 0.00418252
Force max component initial, final = 7507.11 0.000933206
Final line search alpha, max atom move = 0.000488281 4.55667e-07
Iterations, force evaluations = 1322 8896
Pair time (%) = 1614.26 (99.9741)
Neigh time (%) = 0.0480235 (0.00297419)
Comm time (%) = 0.0101368 (0.000627795)
Outpt time (%) = 0.13051 (0.00808274)
Other time (%) = 0.229177 (0.0141934)
Nlocal: 877 ave 877 max 877 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost: 0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs: 0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs: 148764 ave 148764 max 148764 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Total # of neighbors = 148764
Ave neighs/atom = 169.628
Neighbor list builds = 19
Dangerous builds = 0
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