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adding first shot at tests with minikube (#13)
* adding first shot at tests with minikube Signed-off-by: vsoch <[email protected]>
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confirm_uninstall, | ||
ensure_no_extra, | ||
get_installdir, | ||
run_capture, | ||
run_command, | ||
) |
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# Copyright 2022-2023 Lawrence Livermore National Security, LLC | ||
# SPDX-License-Identifier: Apache-2.0 | ||
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__version__ = "0.1.0" | ||
__version__ = "0.1.1" | ||
AUTHOR = "Vanessa Sochat" | ||
EMAIL = "[email protected]" | ||
NAME = "flux-cloud" | ||
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tests/lammps/data/k8s-size-4-local/lmp-size-2-minicluster-size-2/log.out
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LAMMPS (29 Sep 2021 - Update 2) | ||
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:98) | ||
using 1 OpenMP thread(s) per MPI task | ||
Reading data file ... | ||
triclinic box = (0.0000000 0.0000000 0.0000000) to (22.326000 11.141200 13.778966) with tilt (0.0000000 -5.0260300 0.0000000) | ||
1 by 1 by 1 MPI processor grid | ||
reading atoms ... | ||
304 atoms | ||
reading velocities ... | ||
304 velocities | ||
read_data CPU = 0.003 seconds | ||
Replicating atoms ... | ||
triclinic box = (0.0000000 0.0000000 0.0000000) to (44.652000 22.282400 27.557932) with tilt (0.0000000 -10.052060 0.0000000) | ||
1 by 1 by 1 MPI processor grid | ||
bounding box image = (0 -1 -1) to (0 1 1) | ||
bounding box extra memory = 0.03 MB | ||
average # of replicas added to proc = 8.00 out of 8 (100.00%) | ||
2432 atoms | ||
replicate CPU = 0.000 seconds | ||
Neighbor list info ... | ||
update every 20 steps, delay 0 steps, check no | ||
max neighbors/atom: 2000, page size: 100000 | ||
master list distance cutoff = 11 | ||
ghost atom cutoff = 11 | ||
binsize = 5.5, bins = 10 5 6 | ||
2 neighbor lists, perpetual/occasional/extra = 2 0 0 | ||
(1) pair reax/c, perpetual | ||
attributes: half, newton off, ghost | ||
pair build: half/bin/newtoff/ghost | ||
stencil: full/ghost/bin/3d | ||
bin: standard | ||
(2) fix qeq/reax, perpetual, copy from (1) | ||
attributes: half, newton off, ghost | ||
pair build: copy | ||
stencil: none | ||
bin: none | ||
Setting up Verlet run ... | ||
Unit style : real | ||
Current step : 0 | ||
Time step : 0.1 | ||
Per MPI rank memory allocation (min/avg/max) = 215.0 | 215.0 | 215.0 Mbytes | ||
Step Temp PotEng Press E_vdwl E_coul Volume | ||
0 300 -113.27833 437.52122 -111.57687 -1.7014647 27418.867 | ||
10 299.38517 -113.27631 1439.2857 -111.57492 -1.7013813 27418.867 | ||
20 300.27107 -113.27884 3764.3739 -111.57762 -1.7012246 27418.867 | ||
30 302.21063 -113.28428 7007.6914 -111.58335 -1.7009363 27418.867 | ||
40 303.52265 -113.28799 9844.84 -111.58747 -1.7005186 27418.867 | ||
50 301.87059 -113.28324 9663.0443 -111.58318 -1.7000524 27418.867 | ||
60 296.67807 -113.26777 7273.7928 -111.56815 -1.6996137 27418.867 | ||
70 292.19999 -113.25435 5533.6428 -111.55514 -1.6992157 27418.867 | ||
80 293.58677 -113.25831 5993.4151 -111.55946 -1.6988533 27418.867 | ||
90 300.62636 -113.27925 7202.8651 -111.58069 -1.6985591 27418.867 | ||
100 305.38276 -113.29357 10085.748 -111.59518 -1.6983875 27418.867 | ||
Loop time of 29.9065 on 1 procs for 100 steps with 2432 atoms | ||
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Performance: 0.029 ns/day, 830.737 hours/ns, 3.344 timesteps/s | ||
99.9% CPU use with 1 MPI tasks x 1 OpenMP threads | ||
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MPI task timing breakdown: | ||
Section | min time | avg time | max time |%varavg| %total | ||
--------------------------------------------------------------- | ||
Pair | 22.01 | 22.01 | 22.01 | 0.0 | 73.60 | ||
Neigh | 0.58707 | 0.58707 | 0.58707 | 0.0 | 1.96 | ||
Comm | 0.0092962 | 0.0092962 | 0.0092962 | 0.0 | 0.03 | ||
Output | 0.00033026 | 0.00033026 | 0.00033026 | 0.0 | 0.00 | ||
Modify | 7.2985 | 7.2985 | 7.2985 | 0.0 | 24.40 | ||
Other | | 0.001511 | | | 0.01 | ||
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Nlocal: 2432.00 ave 2432 max 2432 min | ||
Histogram: 1 0 0 0 0 0 0 0 0 0 | ||
Nghost: 10685.0 ave 10685 max 10685 min | ||
Histogram: 1 0 0 0 0 0 0 0 0 0 | ||
Neighs: 823958.0 ave 823958 max 823958 min | ||
Histogram: 1 0 0 0 0 0 0 0 0 0 | ||
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Total # of neighbors = 823958 | ||
Ave neighs/atom = 338.79852 | ||
Neighbor list builds = 5 | ||
Dangerous builds not checked | ||
Total wall time: 0:00:30 |
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