69 lines
2.4 KiB
Plaintext
69 lines
2.4 KiB
Plaintext
LAMMPS (12 Jan 2013)
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Lattice spacing in x,y,z = 3.615 3.615 3.615
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Created orthogonal box = (-65.07 -10.845 -10.845) to (65.07 10.845 10.845)
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1 by 1 by 1 MPI processor grid
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Created 4896 atoms
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4608 atoms in group internal
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Constructing ATC transfer (hardy)
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atomPE compute created with ID: 3
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ATC:: created FEM Mesh with 40 Global Nodes, 10 Unique Nodes, and 9 Elements
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Setting up run ...
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ATC:: computing bond matrix ...........done
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ATC:: conversion factor for energy/vol -> stress 1.60218e+06
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ATC:: cutoff radius 4.95
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Memory usage per processor = 8.83292 Mbytes
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Step PotEng KinEng Press Lx Ly Lz
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0 -17256.022 0 -2117.8338 130.14 21.69 21.69
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1 -17256.022 0 -2117.8338 130.14 21.69 21.69
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Loop time of 0.0626969 on 1 procs for 1 steps with 4896 atoms
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Pair time (%) = 0.0204611 (32.6349)
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Neigh time (%) = 0 (0)
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Comm time (%) = 0.000186682 (0.297753)
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Outpt time (%) = 8.2016e-05 (0.130813)
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Other time (%) = 0.0419672 (66.9365)
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Nlocal: 4896 ave 4896 max 4896 min
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Histogram: 1 0 0 0 0 0 0 0 0 0
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Nghost: 6120 ave 6120 max 6120 min
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Histogram: 1 0 0 0 0 0 0 0 0 0
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Neighs: 130032 ave 130032 max 130032 min
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Histogram: 1 0 0 0 0 0 0 0 0 0
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FullNghs: 260064 ave 260064 max 260064 min
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Histogram: 1 0 0 0 0 0 0 0 0 0
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Total # of neighbors = 260064
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Ave neighs/atom = 53.1176
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Neighbor list builds = 0
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Dangerous builds = 0
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Displacing atoms ...
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ATC:: Warning : text output can create _LARGE_ files
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Setting up run ...
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ATC:: conversion factor for energy/vol -> stress 1.60218e+06
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ATC:: cutoff radius 4.95
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Memory usage per processor = 9.13809 Mbytes
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Step PotEng KinEng Press Lx Ly Lz
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1 -17252.771 0 -14787.592 130.14 21.69 21.69
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2 -17252.771 0 -14787.592 130.14 21.69 21.69
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Loop time of 0.23357 on 1 procs for 1 steps with 4896 atoms
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Pair time (%) = 0.020292 (8.68778)
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Neigh time (%) = 0 (0)
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Comm time (%) = 0.000166893 (0.0714531)
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Outpt time (%) = 6.38962e-05 (0.0273563)
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Other time (%) = 0.213047 (91.2134)
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Nlocal: 4896 ave 4896 max 4896 min
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Histogram: 1 0 0 0 0 0 0 0 0 0
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Nghost: 6120 ave 6120 max 6120 min
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Histogram: 1 0 0 0 0 0 0 0 0 0
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Neighs: 130032 ave 130032 max 130032 min
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Histogram: 1 0 0 0 0 0 0 0 0 0
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FullNghs: 260064 ave 260064 max 260064 min
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Histogram: 1 0 0 0 0 0 0 0 0 0
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Total # of neighbors = 260064
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Ave neighs/atom = 53.1176
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Neighbor list builds = 0
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Dangerous builds = 0
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