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update example outputs

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Axel Kohlmeyer
2017-05-18 00:46:49 -04:00
parent 24654ad28f
commit 0208fe9996
12 changed files with 535 additions and 317 deletions
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22
examples/python/log.4May17.pair_python_spce.g++.1
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@ -90,22 +90,22 @@ Step Temp E_pair E_mol TotEng Press
80 182.94811 -18155.978 0 -16520.523 -2393.3156
90 191.29902 -18197.887 0 -16487.779 -2242.7104
100 194.70949 -18195.021 0 -16454.425 -1955.2916
Loop time of 23.0818 on 1 procs for 100 steps with 4500 atoms
Loop time of 23.5385 on 1 procs for 100 steps with 4500 atoms
Performance: 0.374 ns/day, 64.116 hours/ns, 4.332 timesteps/s
Performance: 0.367 ns/day, 65.385 hours/ns, 4.248 timesteps/s
98.9% CPU use with 1 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 21.186 | 21.186 | 21.186 | 0.0 | 91.79
Bond | 0.00022054 | 0.00022054 | 0.00022054 | 0.0 | 0.00
Kspace | 1.5442 | 1.5442 | 1.5442 | 0.0 | 6.69
Neigh | 0.25672 | 0.25672 | 0.25672 | 0.0 | 1.11
Comm | 0.023787 | 0.023787 | 0.023787 | 0.0 | 0.10
Output | 0.00060248 | 0.00060248 | 0.00060248 | 0.0 | 0.00
Modify | 0.064809 | 0.064809 | 0.064809 | 0.0 | 0.28
Other | | 0.005301 | | | 0.02
Pair | 21.642 | 21.642 | 21.642 | 0.0 | 91.94
Bond | 0.00021696 | 0.00021696 | 0.00021696 | 0.0 | 0.00
Kspace | 1.5436 | 1.5436 | 1.5436 | 0.0 | 6.56
Neigh | 0.25623 | 0.25623 | 0.25623 | 0.0 | 1.09
Comm | 0.024325 | 0.024325 | 0.024325 | 0.0 | 0.10
Output | 0.00064301 | 0.00064301 | 0.00064301 | 0.0 | 0.00
Modify | 0.065919 | 0.065919 | 0.065919 | 0.0 | 0.28
Other | | 0.005401 | | | 0.02
Nlocal: 4500 ave 4500 max 4500 min
Histogram: 1 0 0 0 0 0 0 0 0 0
@ -119,4 +119,4 @@ Ave neighs/atom = 578.169
Ave special neighs/atom = 2
Neighbor list builds = 3
Dangerous builds = 0
Total wall time: 0:00:23
Total wall time: 0:00:24