5302074b3f
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10709 f3b2605a-c512-4ea7-a41b-209d697bcdaa
69 lines
2.3 KiB
Plaintext
69 lines
2.3 KiB
Plaintext
LAMMPS (30 Aug 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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4 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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ATC: constructing kernel field estimate
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ATC: version 2.0
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ATC: peratom PE compute created with ID: 3
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ATC: created uniform mesh with 40 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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Memory usage per processor = 12.3855 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 0.00503403 on 4 procs for 1 steps with 4896 atoms
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Pair time (%) = 0.00445276 (88.4533)
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Neigh time (%) = 0 (0)
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Comm time (%) = 0.000399053 (7.92711)
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Outpt time (%) = 8.45194e-05 (1.67896)
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Other time (%) = 9.7692e-05 (1.94063)
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Nlocal: 1224 ave 1296 max 1152 min
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Histogram: 2 0 0 0 0 0 0 0 0 2
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Nghost: 2259 ave 2592 max 1926 min
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Histogram: 2 0 0 0 0 0 0 0 0 2
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Neighs: 32508 ave 34992 max 29952 min
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Histogram: 2 0 0 0 0 0 0 0 0 2
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FullNghs: 65016 ave 69984 max 60048 min
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Histogram: 2 0 0 0 0 0 0 0 0 2
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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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ATC: output custom names:
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Setting up run ...
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ATC: computing bond matrix ..........done
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Memory usage per processor = 12.3855 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 0.0662282 on 4 procs for 1 steps with 4896 atoms
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Pair time (%) = 0.00455725 (6.88113)
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Neigh time (%) = 0 (0)
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Comm time (%) = 0.000357509 (0.539813)
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Outpt time (%) = 0.000589728 (0.890449)
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Other time (%) = 0.0607237 (91.6886)
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Nlocal: 1224 ave 1296 max 1152 min
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Histogram: 2 0 0 0 0 0 0 0 0 2
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Nghost: 2259 ave 2592 max 1926 min
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Histogram: 2 0 0 0 0 0 0 0 0 2
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Neighs: 32508 ave 34992 max 29952 min
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Histogram: 2 0 0 0 0 0 0 0 0 2
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FullNghs: 65016 ave 69984 max 60048 min
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Histogram: 2 0 0 0 0 0 0 0 0 2
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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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