ATC version 2.0, date: Aug28
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10696 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
@ -1,4 +1,4 @@
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LAMMPS (24 Aug 2013)
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LAMMPS (27 Aug 2013)
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units real
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atom_style atomic
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@ -85,13 +85,13 @@ Step Temp PotEng AtC[2] AtC[4]
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80 17.028137 -6478.0796 0.55504167 20.530699
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90 16.865355 -6473.5664 0.41999569 20.372106
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100 17.920474 -6481.673 1.6267665 20.219157
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Loop time of 4.96497 on 4 procs for 100 steps with 3456 atoms
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Loop time of 4.94615 on 4 procs for 100 steps with 3456 atoms
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Pair time (%) = 0.955477 (19.2444)
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Neigh time (%) = 0.417296 (8.40481)
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Comm time (%) = 0.323984 (6.5254)
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Outpt time (%) = 0.00744802 (0.150011)
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Other time (%) = 3.26076 (65.6754)
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Pair time (%) = 0.930216 (18.8069)
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Neigh time (%) = 0.426528 (8.62344)
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Comm time (%) = 0.300557 (6.07658)
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Outpt time (%) = 0.00703555 (0.142243)
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Other time (%) = 3.28181 (66.3509)
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Nlocal: 864 ave 864 max 864 min
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Histogram: 4 0 0 0 0 0 0 0 0 0
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@ -1,4 +1,4 @@
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LAMMPS (24 Aug 2013)
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LAMMPS (27 Aug 2013)
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units real
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atom_style atomic
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@ -116,13 +116,13 @@ Step Temp PotEng AtC[2] AtC[4]
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380 9.2908989 -2851.9001 20 22.619065
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390 9.2908989 -2852.2299 20 22.619065
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400 9.2908989 -2852.6005 20 22.619065
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Loop time of 18.7481 on 4 procs for 400 steps with 1792 atoms
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Loop time of 18.4704 on 4 procs for 400 steps with 1792 atoms
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Pair time (%) = 1.11475 (5.94593)
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Pair time (%) = 1.07522 (5.82131)
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Neigh time (%) = 0 (0)
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Comm time (%) = 0.511455 (2.72804)
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Outpt time (%) = 0.0274233 (0.146273)
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Other time (%) = 17.0945 (91.1798)
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Comm time (%) = 0.480759 (2.60287)
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Outpt time (%) = 0.00380301 (0.0205898)
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Other time (%) = 16.9106 (91.5552)
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Nlocal: 448 ave 448 max 448 min
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Histogram: 4 0 0 0 0 0 0 0 0 0
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@ -264,13 +264,13 @@ Step Temp PotEng AtC[2] AtC[4]
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1380 12.444674 -2883.9691 22.539592 22.343613
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1390 12.360208 -2883.6693 22.496432 22.342016
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1400 12.266237 -2883.307 22.447301 22.340354
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Loop time of 111.476 on 4 procs for 1000 steps with 1792 atoms
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Loop time of 109.452 on 4 procs for 1000 steps with 1792 atoms
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Pair time (%) = 2.77532 (2.48962)
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Neigh time (%) = 0.0119531 (0.0107226)
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Comm time (%) = 0.821557 (0.736984)
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Outpt time (%) = 0.994712 (0.892314)
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Other time (%) = 106.872 (95.8704)
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Pair time (%) = 2.82032 (2.57677)
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Neigh time (%) = 0.0123123 (0.0112491)
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Comm time (%) = 0.870483 (0.795311)
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Outpt time (%) = 1.21121 (1.10661)
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Other time (%) = 104.538 (95.5101)
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Nlocal: 448 ave 448 max 448 min
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Histogram: 4 0 0 0 0 0 0 0 0 0
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@ -1,4 +1,4 @@
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LAMMPS (24 Aug 2013)
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LAMMPS (27 Aug 2013)
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units real
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atom_style atomic
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@ -84,13 +84,13 @@ Step Temp PotEng AtC[2] AtC[4]
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80 10.015134 -3732.7051 20.022115 21.767782
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90 10.008795 -3732.612 20.017899 21.778957
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100 10.001827 -3732.5177 20.013234 21.790338
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Loop time of 12.9624 on 4 procs for 100 steps with 2304 atoms
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Loop time of 15.304 on 4 procs for 100 steps with 2304 atoms
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Pair time (%) = 0.350742 (2.70583)
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Pair time (%) = 0.365796 (2.3902)
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Neigh time (%) = 0 (0)
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Comm time (%) = 0.0351455 (0.271133)
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Outpt time (%) = 0.13561 (1.04617)
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Other time (%) = 12.4409 (95.9769)
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Comm time (%) = 0.266705 (1.74272)
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Outpt time (%) = 0.134717 (0.880274)
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Other time (%) = 14.5368 (94.9868)
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Nlocal: 576 ave 576 max 576 min
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Histogram: 4 0 0 0 0 0 0 0 0 0
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@ -1,4 +1,4 @@
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LAMMPS (24 Aug 2013)
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LAMMPS (27 Aug 2013)
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units real
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atom_style atomic
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@ -76,13 +76,13 @@ Step Temp PotEng AtC[2] AtC[4]
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80 10.020335 -3732.7341 20.045647 21.476176
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90 10.015946 -3732.6496 20.047969 21.468622
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100 10.011086 -3732.5676 20.049857 21.461569
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Loop time of 17.52 on 4 procs for 100 steps with 2304 atoms
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Loop time of 15.9294 on 4 procs for 100 steps with 2304 atoms
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Pair time (%) = 0.352515 (2.01208)
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Pair time (%) = 0.349922 (2.19671)
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Neigh time (%) = 0 (0)
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Comm time (%) = 0.104245 (0.595005)
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Outpt time (%) = 0.213501 (1.21862)
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Other time (%) = 16.8497 (96.1743)
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Comm time (%) = 0.0191067 (0.119946)
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Outpt time (%) = 0.1896 (1.19025)
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Other time (%) = 15.3708 (96.4931)
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Nlocal: 576 ave 576 max 576 min
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Histogram: 4 0 0 0 0 0 0 0 0 0
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@ -1,4 +1,4 @@
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LAMMPS (24 Aug 2013)
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LAMMPS (27 Aug 2013)
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units real
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atom_style atomic
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@ -45,82 +45,81 @@ ATC: constructing two_temperature coupling with parameter file Ar_ttm.mat
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fix_modify AtC mesh read gaussianIC2d_hex_uniform.exo f f p
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ATC: P0, ERROR: mesh file is of unknown type.
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terminate called after throwing an instance of 'ATC::ATC_Error'
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[pharsalus:10268] *** Process received signal ***
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[pharsalus:10268] Signal: Aborted (6)
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[pharsalus:10268] Signal code: (-6)
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[pharsalus:33367] *** Process received signal ***
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[pharsalus:33367] Signal: Aborted (6)
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[pharsalus:33367] Signal code: (-6)
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terminate called after throwing an instance of 'ATC::ATC_Error'
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[pharsalus:10270] *** Process received signal ***
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[pharsalus:10270] Signal: Aborted (6)
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[pharsalus:10270] Signal code: (-6)
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[pharsalus:33356] *** Process received signal ***
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||||
[pharsalus:33356] Signal: Aborted (6)
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||||
[pharsalus:33356] Signal code: (-6)
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terminate called after throwing an instance of 'ATC::ATC_Error'
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[pharsalus:10272] *** Process received signal ***
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||||
[pharsalus:10272] Signal: Aborted (6)
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||||
[pharsalus:10272] Signal code: (-6)
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||||
[pharsalus:33359] *** Process received signal ***
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||||
[pharsalus:33359] Signal: Aborted (6)
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||||
[pharsalus:33359] Signal code: (-6)
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||||
terminate called after throwing an instance of 'ATC::ATC_Error'
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[pharsalus:10264] *** Process received signal ***
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||||
[pharsalus:10264] Signal: Aborted (6)
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||||
[pharsalus:10264] Signal code: (-6)
|
||||
[pharsalus:10272] [ 0] /lib64/libpthread.so.0() [0x3e7ce0f500]
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||||
[pharsalus:10272] [ 1] /lib64/libc.so.6(gsignal+0x35) [0x3e7c2328a5]
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||||
[pharsalus:10272] [ 2] /lib64/libc.so.6(abort+0x175) [0x3e7c234085]
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||||
[pharsalus:10272] [ 3] /usr/lib64/libstdc++.so.6(_ZN9__gnu_cxx27__verbose_terminate_handlerEv+0x12d) [0x3e83ebea5d]
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||||
[pharsalus:10272] [ 4] /usr/lib64/libstdc++.so.6() [0x3e83ebcbe6]
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||||
[pharsalus:10272] [ 5] /usr/lib64/libstdc++.so.6() [0x3e83ebcc13]
|
||||
[pharsalus:10272] [ 6] /usr/lib64/libstdc++.so.6(__cxa_rethrow+0x46) [0x3e83ebcc96]
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||||
[pharsalus:10272] [ 7] ../../../lmp_openmpi(_ZN9LAMMPS_NS6FixATC12modify_paramEiPPc+0x70) [0x68d540]
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||||
[pharsalus:10272] [ 8] ../../../lmp_openmpi(_ZN9LAMMPS_NS3Fix13modify_paramsEiPPc+0xb9) [0x6b5709]
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||||
[pharsalus:10272] [ 9] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input15execute_commandEv+0xcab) [0x795e7b]
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||||
[pharsalus:10272] [10] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input4fileEv+0x63c) [0x79795c]
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||||
[pharsalus:10272] [11] ../../../lmp_openmpi(main+0x49) [0x7a5899]
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||||
[pharsalus:10272] [12] /lib64/libc.so.6(__libc_start_main+0xfd) [0x3e7c21ecdd]
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||||
[pharsalus:10272] [13] ../../../lmp_openmpi() [0x538069]
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||||
[pharsalus:10272] *** End of error message ***
|
||||
[pharsalus:10268] [ 0] /lib64/libpthread.so.0() [0x3e7ce0f500]
|
||||
[pharsalus:10268] [ 1] /lib64/libc.so.6(gsignal+0x35) [0x3e7c2328a5]
|
||||
[pharsalus:10268] [ 2] /lib64/libc.so.6(abort+0x175) [0x3e7c234085]
|
||||
[pharsalus:10268] [ 3] /usr/lib64/libstdc++.so.6(_ZN9__gnu_cxx27__verbose_terminate_handlerEv+0x12d) [0x3e83ebea5d]
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||||
[pharsalus:10268] [ 4] /usr/lib64/libstdc++.so.6() [0x3e83ebcbe6]
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||||
[pharsalus:10268] [ 5] /usr/lib64/libstdc++.so.6() [0x3e83ebcc13]
|
||||
[pharsalus:10268] [ 6] /usr/lib64/libstdc++.so.6(__cxa_rethrow+0x46) [0x3e83ebcc96]
|
||||
[pharsalus:10268] [ 7] ../../../lmp_openmpi(_ZN9LAMMPS_NS6FixATC12modify_paramEiPPc+0x70) [0x68d540]
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||||
[pharsalus:10268] [ 8] ../../../lmp_openmpi(_ZN9LAMMPS_NS3Fix13modify_paramsEiPPc+0xb9) [0x6b5709]
|
||||
[pharsalus:10268] [ 9] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input15execute_commandEv+0xcab) [0x795e7b]
|
||||
[pharsalus:10268] [10] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input4fileEv+0x63c) [0x79795c]
|
||||
[pharsalus:10268] [11] ../../../lmp_openmpi(main+0x49) [0x7a5899]
|
||||
[pharsalus:10268] [12] /lib64/libc.so.6(__libc_start_main+0xfd) [0x3e7c21ecdd]
|
||||
[pharsalus:10268] [13] ../../../lmp_openmpi() [0x538069]
|
||||
[pharsalus:10268] *** End of error message ***
|
||||
[pharsalus:10270] [ 0] /lib64/libpthread.so.0() [0x3e7ce0f500]
|
||||
[pharsalus:10270] [ 1] /lib64/libc.so.6(gsignal+0x35) [0x3e7c2328a5]
|
||||
[pharsalus:10270] [ 2] /lib64/libc.so.6(abort+0x175) [0x3e7c234085]
|
||||
[pharsalus:10270] [ 3] /usr/lib64/libstdc++.so.6(_ZN9__gnu_cxx27__verbose_terminate_handlerEv+0x12d) [0x3e83ebea5d]
|
||||
[pharsalus:10270] [ 4] /usr/lib64/libstdc++.so.6() [0x3e83ebcbe6]
|
||||
[pharsalus:10270] [ 5] /usr/lib64/libstdc++.so.6() [0x3e83ebcc13]
|
||||
[pharsalus:10270] [ 6] /usr/lib64/libstdc++.so.6(__cxa_rethrow+0x46) [0x3e83ebcc96]
|
||||
[pharsalus:10270] [ 7] ../../../lmp_openmpi(_ZN9LAMMPS_NS6FixATC12modify_paramEiPPc+0x70) [0x68d540]
|
||||
[pharsalus:10270] [ 8] ../../../lmp_openmpi(_ZN9LAMMPS_NS3Fix13modify_paramsEiPPc+0xb9) [0x6b5709]
|
||||
[pharsalus:10270] [ 9] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input15execute_commandEv+0xcab) [0x795e7b]
|
||||
[pharsalus:10270] [10] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input4fileEv+0x63c) [0x79795c]
|
||||
[pharsalus:10270] [11] ../../../lmp_openmpi(main+0x49) [0x7a5899]
|
||||
[pharsalus:10270] [12] /lib64/libc.so.6(__libc_start_main+0xfd) [0x3e7c21ecdd]
|
||||
[pharsalus:10270] [13] ../../../lmp_openmpi() [0x538069]
|
||||
[pharsalus:10270] *** End of error message ***
|
||||
[pharsalus:10264] [ 0] /lib64/libpthread.so.0() [0x3e7ce0f500]
|
||||
[pharsalus:10264] [ 1] /lib64/libc.so.6(gsignal+0x35) [0x3e7c2328a5]
|
||||
[pharsalus:10264] [ 2] /lib64/libc.so.6(abort+0x175) [0x3e7c234085]
|
||||
[pharsalus:10264] [ 3] /usr/lib64/libstdc++.so.6(_ZN9__gnu_cxx27__verbose_terminate_handlerEv+0x12d) [0x3e83ebea5d]
|
||||
[pharsalus:10264] [ 4] /usr/lib64/libstdc++.so.6() [0x3e83ebcbe6]
|
||||
[pharsalus:10264] [ 5] /usr/lib64/libstdc++.so.6() [0x3e83ebcc13]
|
||||
[pharsalus:10264] [ 6] /usr/lib64/libstdc++.so.6(__cxa_rethrow+0x46) [0x3e83ebcc96]
|
||||
[pharsalus:10264] [ 7] ../../../lmp_openmpi(_ZN9LAMMPS_NS6FixATC12modify_paramEiPPc+0x70) [0x68d540]
|
||||
[pharsalus:10264] [ 8] ../../../lmp_openmpi(_ZN9LAMMPS_NS3Fix13modify_paramsEiPPc+0xb9) [0x6b5709]
|
||||
[pharsalus:10264] [ 9] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input15execute_commandEv+0xcab) [0x795e7b]
|
||||
[pharsalus:10264] [10] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input4fileEv+0x63c) [0x79795c]
|
||||
[pharsalus:10264] [11] ../../../lmp_openmpi(main+0x49) [0x7a5899]
|
||||
[pharsalus:10264] [12] /lib64/libc.so.6(__libc_start_main+0xfd) [0x3e7c21ecdd]
|
||||
[pharsalus:10264] [13] ../../../lmp_openmpi() [0x538069]
|
||||
[pharsalus:10264] *** End of error message ***
|
||||
[pharsalus:33363] *** Process received signal ***
|
||||
[pharsalus:33363] Signal: Aborted (6)
|
||||
[pharsalus:33363] Signal code: (-6)
|
||||
[pharsalus:33367] [ 0] /lib64/libpthread.so.0() [0x3e7ce0f500]
|
||||
[pharsalus:33367] [ 1] /lib64/libc.so.6(gsignal+0x35) [0x3e7c2328a5]
|
||||
[pharsalus:33367] [ 2] /lib64/libc.so.6(abort+0x175) [0x3e7c234085]
|
||||
[pharsalus:33367] [ 3] /usr/lib64/libstdc++.so.6(_ZN9__gnu_cxx27__verbose_terminate_handlerEv+0x12d) [0x3e83ebea5d]
|
||||
[pharsalus:33367] [ 4] /usr/lib64/libstdc++.so.6() [0x3e83ebcbe6]
|
||||
[pharsalus:33367] [ 5] /usr/lib64/libstdc++.so.6() [0x3e83ebcc13]
|
||||
[pharsalus:33367] [ 6] /usr/lib64/libstdc++.so.6(__cxa_rethrow+0x46) [0x3e83ebcc96]
|
||||
[pharsalus:33367] [ 7] ../../../lmp_openmpi(_ZN9LAMMPS_NS6FixATC12modify_paramEiPPc+0x70) [0x694a60]
|
||||
[pharsalus:33367] [ 8] ../../../lmp_openmpi(_ZN9LAMMPS_NS3Fix13modify_paramsEiPPc+0xb9) [0x6bcc29]
|
||||
[pharsalus:33367] [ 9] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input15execute_commandEv+0xcab) [0x79e68b]
|
||||
[pharsalus:33367] [10] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input4fileEv+0x63c) [0x7a016c]
|
||||
[pharsalus:33367] [11] ../../../lmp_openmpi(main+0x49) [0x7ae0f9]
|
||||
[pharsalus:33367] [12] /lib64/libc.so.6(__libc_start_main+0xfd) [0x3e7c21ecdd]
|
||||
[pharsalus:33367] [13] ../../../lmp_openmpi() [0x53a009]
|
||||
[pharsalus:33367] *** End of error message ***
|
||||
[pharsalus:33356] [ 0] /lib64/libpthread.so.0() [0x3e7ce0f500]
|
||||
[pharsalus:33356] [ 1] /lib64/libc.so.6(gsignal+0x35) [0x3e7c2328a5]
|
||||
[pharsalus:33356] [ 2] /lib64/libc.so.6(abort+0x175) [0x3e7c234085]
|
||||
[pharsalus:33356] [ 3] /usr/lib64/libstdc++.so.6(_ZN9__gnu_cxx27__verbose_terminate_handlerEv+0x12d) [0x3e83ebea5d]
|
||||
[pharsalus:33356] [ 4] /usr/lib64/libstdc++.so.6() [0x3e83ebcbe6]
|
||||
[pharsalus:33356] [ 5] /usr/lib64/libstdc++.so.6() [0x3e83ebcc13]
|
||||
[pharsalus:33356] [ 6] /usr/lib64/libstdc++.so.6(__cxa_rethrow+0x46) [0x3e83ebcc96]
|
||||
[pharsalus:33356] [ 7] ../../../lmp_openmpi(_ZN9LAMMPS_NS6FixATC12modify_paramEiPPc+0x70) [0x694a60]
|
||||
[pharsalus:33356] [ 8] ../../../lmp_openmpi(_ZN9LAMMPS_NS3Fix13modify_paramsEiPPc+0xb9) [0x6bcc29]
|
||||
[pharsalus:33356] [ 9] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input15execute_commandEv+0xcab) [0x79e68b]
|
||||
[pharsalus:33356] [10] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input4fileEv+0x63c) [0x7a016c]
|
||||
[pharsalus:33356] [11] ../../../lmp_openmpi(main+0x49) [0x7ae0f9]
|
||||
[pharsalus:33356] [12] /lib64/libc.so.6(__libc_start_main+0xfd) [0x3e7c21ecdd]
|
||||
[pharsalus:33356] [13] ../../../lmp_openmpi() [0x53a009]
|
||||
[pharsalus:33356] *** End of error message ***
|
||||
[pharsalus:33359] [ 0] /lib64/libpthread.so.0() [0x3e7ce0f500]
|
||||
[pharsalus:33359] [ 1] /lib64/libc.so.6(gsignal+0x35) [0x3e7c2328a5]
|
||||
[pharsalus:33359] [ 2] /lib64/libc.so.6(abort+0x175) [0x3e7c234085]
|
||||
[pharsalus:33359] [ 3] /usr/lib64/libstdc++.so.6(_ZN9__gnu_cxx27__verbose_terminate_handlerEv+0x12d) [0x3e83ebea5d]
|
||||
[pharsalus:33359] [ 4] /usr/lib64/libstdc++.so.6() [0x3e83ebcbe6]
|
||||
[pharsalus:33359] [ 5] /usr/lib64/libstdc++.so.6() [0x3e83ebcc13]
|
||||
[pharsalus:33359] [ 6] /usr/lib64/libstdc++.so.6(__cxa_rethrow+0x46) [0x3e83ebcc96]
|
||||
[pharsalus:33359] [ 7] ../../../lmp_openmpi(_ZN9LAMMPS_NS6FixATC12modify_paramEiPPc+0x70) [0x694a60]
|
||||
[pharsalus:33359] [ 8] ../../../lmp_openmpi(_ZN9LAMMPS_NS3Fix13modify_paramsEiPPc+0xb9) [0x6bcc29]
|
||||
[pharsalus:33359] [ 9] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input15execute_commandEv+0xcab) [0x79e68b]
|
||||
[pharsalus:33359] [10] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input4fileEv+0x63c) [0x7a016c]
|
||||
[pharsalus:33359] [11] ../../../lmp_openmpi(main+0x49) [0x7ae0f9]
|
||||
[pharsalus:33359] [12] /lib64/libc.so.6(__libc_start_main+0xfd) [0x3e7c21ecdd]
|
||||
[pharsalus:33359] [13] ../../../lmp_openmpi() [0x53a009]
|
||||
[pharsalus:33359] *** End of error message ***
|
||||
[pharsalus:33363] [ 0] /lib64/libpthread.so.0() [0x3e7ce0f500]
|
||||
[pharsalus:33363] [ 1] /lib64/libc.so.6(gsignal+0x35) [0x3e7c2328a5]
|
||||
[pharsalus:33363] [ 2] /lib64/libc.so.6(abort+0x175) [0x3e7c234085]
|
||||
[pharsalus:33363] [ 3] /usr/lib64/libstdc++.so.6(_ZN9__gnu_cxx27__verbose_terminate_handlerEv+0x12d) [0x3e83ebea5d]
|
||||
[pharsalus:33363] [ 4] /usr/lib64/libstdc++.so.6() [0x3e83ebcbe6]
|
||||
[pharsalus:33363] [ 5] /usr/lib64/libstdc++.so.6() [0x3e83ebcc13]
|
||||
[pharsalus:33363] [ 6] /usr/lib64/libstdc++.so.6(__cxa_rethrow+0x46) [0x3e83ebcc96]
|
||||
[pharsalus:33363] [ 7] ../../../lmp_openmpi(_ZN9LAMMPS_NS6FixATC12modify_paramEiPPc+0x70) [0x694a60]
|
||||
[pharsalus:33363] [ 8] ../../../lmp_openmpi(_ZN9LAMMPS_NS3Fix13modify_paramsEiPPc+0xb9) [0x6bcc29]
|
||||
[pharsalus:33363] [ 9] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input15execute_commandEv+0xcab) [0x79e68b]
|
||||
[pharsalus:33363] [10] ../../../lmp_openmpi(_ZN9LAMMPS_NS5Input4fileEv+0x63c) [0x7a016c]
|
||||
[pharsalus:33363] [11] ../../../lmp_openmpi(main+0x49) [0x7ae0f9]
|
||||
[pharsalus:33363] [12] /lib64/libc.so.6(__libc_start_main+0xfd) [0x3e7c21ecdd]
|
||||
[pharsalus:33363] [13] ../../../lmp_openmpi() [0x53a009]
|
||||
[pharsalus:33363] *** End of error message ***
|
||||
--------------------------------------------------------------------------
|
||||
mpirun noticed that process rank 2 with PID 10270 on node pharsalus exited on signal 6 (Aborted).
|
||||
mpirun noticed that process rank 3 with PID 33367 on node pharsalus exited on signal 6 (Aborted).
|
||||
--------------------------------------------------------------------------
|
||||
3 total processes killed (some possibly by mpirun during cleanup)
|
||||
|
||||
@ -1,4 +1,4 @@
|
||||
LAMMPS (24 Aug 2013)
|
||||
LAMMPS (27 Aug 2013)
|
||||
units real
|
||||
atom_style atomic
|
||||
|
||||
@ -79,13 +79,13 @@ Step Temp PotEng AtC[2] AtC[4]
|
||||
80 10.018854 -3732.6191 20.018692 21.657452
|
||||
90 10.008439 -3732.4929 20.013835 21.653444
|
||||
100 9.995993 -3732.3576 20.008205 21.649488
|
||||
Loop time of 41.7235 on 4 procs for 100 steps with 2304 atoms
|
||||
Loop time of 41.8226 on 4 procs for 100 steps with 2304 atoms
|
||||
|
||||
Pair time (%) = 0.366258 (0.877822)
|
||||
Pair time (%) = 0.376811 (0.900975)
|
||||
Neigh time (%) = 0 (0)
|
||||
Comm time (%) = 0.397571 (0.952871)
|
||||
Outpt time (%) = 0.0817724 (0.195987)
|
||||
Other time (%) = 40.8779 (97.9733)
|
||||
Comm time (%) = 0.128205 (0.306545)
|
||||
Outpt time (%) = 0.0721631 (0.172546)
|
||||
Other time (%) = 41.2454 (98.6199)
|
||||
|
||||
Nlocal: 576 ave 576 max 576 min
|
||||
Histogram: 4 0 0 0 0 0 0 0 0 0
|
||||
|
||||
@ -1,4 +1,4 @@
|
||||
LAMMPS (24 Aug 2013)
|
||||
LAMMPS (27 Aug 2013)
|
||||
units real
|
||||
atom_style atomic
|
||||
|
||||
@ -56,15 +56,15 @@ Setting up run ...
|
||||
Memory usage per processor = 490.313 Mbytes
|
||||
Step CPU Temp
|
||||
0 0 0
|
||||
1 0.0049498081 0
|
||||
2 0.013142824 0
|
||||
Loop time of 0.0131559 on 4 procs for 2 steps with 2304 atoms
|
||||
1 0.0049510002 0
|
||||
2 0.013290882 0
|
||||
Loop time of 0.0133031 on 4 procs for 2 steps with 2304 atoms
|
||||
|
||||
Pair time (%) = 0.00890332 (67.6753)
|
||||
Pair time (%) = 0.00893497 (67.1646)
|
||||
Neigh time (%) = 0 (0)
|
||||
Comm time (%) = 0.000479043 (3.64126)
|
||||
Outpt time (%) = 0.00257176 (19.5483)
|
||||
Other time (%) = 0.00120181 (9.1351)
|
||||
Comm time (%) = 0.000443518 (3.33395)
|
||||
Outpt time (%) = 0.00268322 (20.1699)
|
||||
Other time (%) = 0.00124139 (9.33155)
|
||||
|
||||
Nlocal: 576 ave 576 max 576 min
|
||||
Histogram: 4 0 0 0 0 0 0 0 0 0
|
||||
|
||||
@ -1,4 +1,4 @@
|
||||
LAMMPS (24 Aug 2013)
|
||||
LAMMPS (27 Aug 2013)
|
||||
units real
|
||||
atom_style atomic
|
||||
|
||||
@ -52,15 +52,15 @@ Setting up run ...
|
||||
Memory usage per processor = 603.85 Mbytes
|
||||
Step CPU Temp
|
||||
0 0 0
|
||||
1 0.004887104 0
|
||||
2 0.015377045 0
|
||||
Loop time of 0.0153884 on 4 procs for 2 steps with 2304 atoms
|
||||
1 0.0049540997 0
|
||||
2 0.014386177 0
|
||||
Loop time of 0.0144055 on 4 procs for 2 steps with 2304 atoms
|
||||
|
||||
Pair time (%) = 0.00924021 (60.0465)
|
||||
Pair time (%) = 0.00892383 (61.9474)
|
||||
Neigh time (%) = 0 (0)
|
||||
Comm time (%) = 0.00127399 (8.27888)
|
||||
Outpt time (%) = 0.00323975 (21.0532)
|
||||
Other time (%) = 0.00163448 (10.6215)
|
||||
Comm time (%) = 0.000519812 (3.60843)
|
||||
Outpt time (%) = 0.0032984 (22.8968)
|
||||
Other time (%) = 0.00166345 (11.5473)
|
||||
|
||||
Nlocal: 576 ave 576 max 576 min
|
||||
Histogram: 4 0 0 0 0 0 0 0 0 0
|
||||
|
||||
@ -1,4 +1,4 @@
|
||||
LAMMPS (24 Aug 2013)
|
||||
LAMMPS (27 Aug 2013)
|
||||
units real
|
||||
atom_style atomic
|
||||
|
||||
@ -53,15 +53,15 @@ Setting up run ...
|
||||
Memory usage per processor = 11.9239 Mbytes
|
||||
Step CPU Temp
|
||||
0 0 0
|
||||
1 0.0049510002 0
|
||||
2 0.014382839 0
|
||||
Loop time of 0.0144005 on 4 procs for 2 steps with 2304 atoms
|
||||
1 0.0050871372 0
|
||||
2 0.01465106 0
|
||||
Loop time of 0.0146735 on 4 procs for 2 steps with 2304 atoms
|
||||
|
||||
Pair time (%) = 0.00893074 (62.017)
|
||||
Pair time (%) = 0.00897056 (61.1345)
|
||||
Neigh time (%) = 0 (0)
|
||||
Comm time (%) = 0.000444293 (3.08526)
|
||||
Outpt time (%) = 0.00327641 (22.7521)
|
||||
Other time (%) = 0.00174904 (12.1457)
|
||||
Comm time (%) = 0.00056076 (3.82159)
|
||||
Outpt time (%) = 0.0033372 (22.7431)
|
||||
Other time (%) = 0.00180495 (12.3008)
|
||||
|
||||
Nlocal: 576 ave 576 max 576 min
|
||||
Histogram: 4 0 0 0 0 0 0 0 0 0
|
||||
|
||||
@ -1,4 +1,4 @@
|
||||
LAMMPS (24 Aug 2013)
|
||||
LAMMPS (27 Aug 2013)
|
||||
units real
|
||||
atom_style atomic
|
||||
|
||||
@ -109,13 +109,13 @@ Step Temp E_pair E_mol TotEng Press
|
||||
300 10.255763 -5191.6455 0 -5094.8288 -564.44341
|
||||
400 10.255763 -5185.5031 0 -5088.6864 -611.34498
|
||||
500 10.255763 -5185.1021 0 -5088.2853 -686.81479
|
||||
Loop time of 11.0593 on 4 procs for 500 steps with 3168 atoms
|
||||
Loop time of 8.85008 on 4 procs for 500 steps with 3168 atoms
|
||||
|
||||
Pair time (%) = 2.74711 (24.8398)
|
||||
Neigh time (%) = 0.0633113 (0.57247)
|
||||
Comm time (%) = 1.36527 (12.345)
|
||||
Outpt time (%) = 0.000416458 (0.00376567)
|
||||
Other time (%) = 6.88321 (62.239)
|
||||
Pair time (%) = 2.42339 (27.3827)
|
||||
Neigh time (%) = 0.0542718 (0.613235)
|
||||
Comm time (%) = 0.651604 (7.36269)
|
||||
Outpt time (%) = 0.000380278 (0.00429688)
|
||||
Other time (%) = 5.72043 (64.6371)
|
||||
|
||||
Nlocal: 792 ave 944 max 640 min
|
||||
Histogram: 2 0 0 0 0 0 0 0 0 2
|
||||
@ -174,13 +174,13 @@ Step Temp E_pair E_mol TotEng Press
|
||||
800 10.245262 -5181.8268 0 -5085.1092 -707.19351
|
||||
900 10.342331 -5183.9012 0 -5086.2673 -667.21622
|
||||
1000 10.446039 -5184.9612 0 -5086.3482 -647.13367
|
||||
Loop time of 27.5223 on 4 procs for 1000 steps with 3168 atoms
|
||||
Loop time of 28.8873 on 4 procs for 1000 steps with 3168 atoms
|
||||
|
||||
Pair time (%) = 4.97271 (18.0679)
|
||||
Neigh time (%) = 0.0969956 (0.352426)
|
||||
Comm time (%) = 1.52383 (5.53671)
|
||||
Outpt time (%) = 0.0563247 (0.204651)
|
||||
Other time (%) = 20.8724 (75.8383)
|
||||
Pair time (%) = 4.99263 (17.2831)
|
||||
Neigh time (%) = 0.0909939 (0.314996)
|
||||
Comm time (%) = 1.76148 (6.09779)
|
||||
Outpt time (%) = 0.0562053 (0.194568)
|
||||
Other time (%) = 21.986 (76.1095)
|
||||
|
||||
Nlocal: 792 ave 944 max 640 min
|
||||
Histogram: 2 0 0 0 0 0 0 0 0 2
|
||||
|
||||
Reference in New Issue
Block a user