* [MAQAO] Info: Detected 192 Lprof instances in gmz12.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.11 Build 20231005 (id: 74c4a23)
[0] MPI startup(): Copyright (C) 2003-2023 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): File "" not found
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2024.0.0/mpi/2021.11/opt/mpi/etc/tuning_generic_shm.dat"
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 57555 gmz12.benchmarkcenter.megware.com 0
[0] MPI startup(): 1 57571 gmz12.benchmarkcenter.megware.com 1
[0] MPI startup(): 2 57675 gmz12.benchmarkcenter.megware.com 2
[0] MPI startup(): 3 57651 gmz12.benchmarkcenter.megware.com 3
[0] MPI startup(): 4 57635 gmz12.benchmarkcenter.megware.com 4
[0] MPI startup(): 5 57559 gmz12.benchmarkcenter.megware.com 5
[0] MPI startup(): 6 57566 gmz12.benchmarkcenter.megware.com 6
[0] MPI startup(): 7 57633 gmz12.benchmarkcenter.megware.com 7
[0] MPI startup(): 8 57531 gmz12.benchmarkcenter.megware.com 8
[0] MPI startup(): 9 57572 gmz12.benchmarkcenter.megware.com 9
[0] MPI startup(): 10 57646 gmz12.benchmarkcenter.megware.com 10
[0] MPI startup(): 11 57558 gmz12.benchmarkcenter.megware.com 11
[0] MPI startup(): 12 57610 gmz12.benchmarkcenter.megware.com 12
[0] MPI startup(): 13 57507 gmz12.benchmarkcenter.megware.com 13
[0] MPI startup(): 14 57560 gmz12.benchmarkcenter.megware.com 14
[0] MPI startup(): 15 57524 gmz12.benchmarkcenter.megware.com 15
[0] MPI startup(): 16 57626 gmz12.benchmarkcenter.megware.com 16
[0] MPI startup(): 17 57514 gmz12.benchmarkcenter.megware.com 17
[0] MPI startup(): 18 57497 gmz12.benchmarkcenter.megware.com 18
[0] MPI startup(): 19 57521 gmz12.benchmarkcenter.megware.com 19
[0] MPI startup(): 20 57580 gmz12.benchmarkcenter.megware.com 20
[0] MPI startup(): 21 57561 gmz12.benchmarkcenter.megware.com 21
[0] MPI startup(): 22 57607 gmz12.benchmarkcenter.megware.com 22
[0] MPI startup(): 23 57679 gmz12.benchmarkcenter.megware.com 23
[0] MPI startup(): 24 57517 gmz12.benchmarkcenter.megware.com 24
[0] MPI startup(): 25 57641 gmz12.benchmarkcenter.megware.com 25
[0] MPI startup(): 26 57639 gmz12.benchmarkcenter.megware.com 26
[0] MPI startup(): 27 57618 gmz12.benchmarkcenter.megware.com 27
[0] MPI startup(): 28 57573 gmz12.benchmarkcenter.megware.com 28
[0] MPI startup(): 29 57525 gmz12.benchmarkcenter.megware.com 29
[0] MPI startup(): 30 57522 gmz12.benchmarkcenter.megware.com 30
[0] MPI startup(): 31 57568 gmz12.benchmarkcenter.megware.com 31
[0] MPI startup(): 32 57519 gmz12.benchmarkcenter.megware.com 32
[0] MPI startup(): 33 57587 gmz12.benchmarkcenter.megware.com 33
[0] MPI startup(): 34 57590 gmz12.benchmarkcenter.megware.com 34
[0] MPI startup(): 35 57503 gmz12.benchmarkcenter.megware.com 35
[0] MPI startup(): 36 57529 gmz12.benchmarkcenter.megware.com 36
[0] MPI startup(): 37 57567 gmz12.benchmarkcenter.megware.com 37
[0] MPI startup(): 38 57556 gmz12.benchmarkcenter.megware.com 38
[0] MPI startup(): 39 57670 gmz12.benchmarkcenter.megware.com 39
[0] MPI startup(): 40 57549 gmz12.benchmarkcenter.megware.com 40
[0] MPI startup(): 41 57606 gmz12.benchmarkcenter.megware.com 41
[0] MPI startup(): 42 57643 gmz12.benchmarkcenter.megware.com 42
[0] MPI startup(): 43 57608 gmz12.benchmarkcenter.megware.com 43
[0] MPI startup(): 44 57578 gmz12.benchmarkcenter.megware.com 44
[0] MPI startup(): 45 57617 gmz12.benchmarkcenter.megware.com 45
[0] MPI startup(): 46 57551 gmz12.benchmarkcenter.megware.com 46
[0] MPI startup(): 47 57604 gmz12.benchmarkcenter.megware.com 47
[0] MPI startup(): 48 57564 gmz12.benchmarkcenter.megware.com 48
[0] MPI startup(): 49 57490 gmz12.benchmarkcenter.megware.com 49
[0] MPI startup(): 50 57563 gmz12.benchmarkcenter.megware.com 50
[0] MPI startup(): 51 57570 gmz12.benchmarkcenter.megware.com 51
[0] MPI startup(): 52 57557 gmz12.benchmarkcenter.megware.com 52
[0] MPI startup(): 53 57605 gmz12.benchmarkcenter.megware.com 53
[0] MPI startup(): 54 57619 gmz12.benchmarkcenter.megware.com 54
[0] MPI startup(): 55 57513 gmz12.benchmarkcenter.megware.com 55
[0] MPI startup(): 56 57575 gmz12.benchmarkcenter.megware.com 56
[0] MPI startup(): 57 57598 gmz12.benchmarkcenter.megware.com 57
[0] MPI startup(): 58 57649 gmz12.benchmarkcenter.megware.com 58
[0] MPI startup(): 59 57597 gmz12.benchmarkcenter.megware.com 59
[0] MPI startup(): 60 57682 gmz12.benchmarkcenter.megware.com 60
[0] MPI startup(): 61 57565 gmz12.benchmarkcenter.megware.com 61
[0] MPI startup(): 62 57532 gmz12.benchmarkcenter.megware.com 62
[0] MPI startup(): 63 57562 gmz12.benchmarkcenter.megware.com 63
[0] MPI startup(): 64 57527 gmz12.benchmarkcenter.megware.com 64
[0] MPI startup(): 65 57550 gmz12.benchmarkcenter.megware.com 65
[0] MPI startup(): 66 57574 gmz12.benchmarkcenter.megware.com 66
[0] MPI startup(): 67 57603 gmz12.benchmarkcenter.megware.com 67
[0] MPI startup(): 68 57600 gmz12.benchmarkcenter.megware.com 68
[0] MPI startup(): 69 57569 gmz12.benchmarkcenter.megware.com 69
[0] MPI startup(): 70 57602 gmz12.benchmarkcenter.megware.com 70
[0] MPI startup(): 71 57553 gmz12.benchmarkcenter.megware.com 71
[0] MPI startup(): 72 57523 gmz12.benchmarkcenter.megware.com 72
[0] MPI startup(): 73 57547 gmz12.benchmarkcenter.megware.com 73
[0] MPI startup(): 74 57636 gmz12.benchmarkcenter.megware.com 74
[0] MPI startup(): 75 57546 gmz12.benchmarkcenter.megware.com 75
[0] MPI startup(): 76 57650 gmz12.benchmarkcenter.megware.com 76
[0] MPI startup(): 77 57496 gmz12.benchmarkcenter.megware.com 77
[0] MPI startup(): 78 57518 gmz12.benchmarkcenter.megware.com 78
[0] MPI startup(): 79 57554 gmz12.benchmarkcenter.megware.com 79
[0] MPI startup(): 80 57609 gmz12.benchmarkcenter.megware.com 80
[0] MPI startup(): 81 57673 gmz12.benchmarkcenter.megware.com 81
[0] MPI startup(): 82 57528 gmz12.benchmarkcenter.megware.com 82
[0] MPI startup(): 83 57613 gmz12.benchmarkcenter.megware.com 83
[0] MPI startup(): 84 57516 gmz12.benchmarkcenter.megware.com 84
[0] MPI startup(): 85 57677 gmz12.benchmarkcenter.megware.com 85
[0] MPI startup(): 86 57667 gmz12.benchmarkcenter.megware.com 86
[0] MPI startup(): 87 57668 gmz12.benchmarkcenter.megware.com 87
[0] MPI startup(): 88 57548 gmz12.benchmarkcenter.megware.com 88
[0] MPI startup(): 89 57644 gmz12.benchmarkcenter.megware.com 89
[0] MPI startup(): 90 57584 gmz12.benchmarkcenter.megware.com 90
[0] MPI startup(): 91 57672 gmz12.benchmarkcenter.megware.com 91
[0] MPI startup(): 92 57642 gmz12.benchmarkcenter.megware.com 92
[0] MPI startup(): 93 57576 gmz12.benchmarkcenter.megware.com 93
[0] MPI startup(): 94 57634 gmz12.benchmarkcenter.megware.com 94
[0] MPI startup(): 95 57542 gmz12.benchmarkcenter.megware.com 95
[0] MPI startup(): 96 57611 gmz12.benchmarkcenter.megware.com 96
[0] MPI startup(): 97 57621 gmz12.benchmarkcenter.megware.com 97
[0] MPI startup(): 98 57674 gmz12.benchmarkcenter.megware.com 98
[0] MPI startup(): 99 57616 gmz12.benchmarkcenter.megware.com 99
[0] MPI startup(): 100 57678 gmz12.benchmarkcenter.megware.com 100
[0] MPI startup(): 101 57652 gmz12.benchmarkcenter.megware.com 101
[0] MPI startup(): 102 57515 gmz12.benchmarkcenter.megware.com 102
[0] MPI startup(): 103 57520 gmz12.benchmarkcenter.megware.com 103
[0] MPI startup(): 104 57582 gmz12.benchmarkcenter.megware.com 104
[0] MPI startup(): 105 57599 gmz12.benchmarkcenter.megware.com 105
[0] MPI startup(): 106 57648 gmz12.benchmarkcenter.megware.com 106
[0] MPI startup(): 107 57664 gmz12.benchmarkcenter.megware.com 107
[0] MPI startup(): 108 57676 gmz12.benchmarkcenter.megware.com 108
[0] MPI startup(): 109 57655 gmz12.benchmarkcenter.megware.com 109
[0] MPI startup(): 110 57647 gmz12.benchmarkcenter.megware.com 110
[0] MPI startup(): 111 57612 gmz12.benchmarkcenter.megware.com 111
[0] MPI startup(): 112 57645 gmz12.benchmarkcenter.megware.com 112
[0] MPI startup(): 113 57671 gmz12.benchmarkcenter.megware.com 113
[0] MPI startup(): 114 57601 gmz12.benchmarkcenter.megware.com 114
[0] MPI startup(): 115 57615 gmz12.benchmarkcenter.megware.com 115
[0] MPI startup(): 116 57620 gmz12.benchmarkcenter.megware.com 116
[0] MPI startup(): 117 57593 gmz12.benchmarkcenter.megware.com 117
[0] MPI startup(): 118 57552 gmz12.benchmarkcenter.megware.com 118
[0] MPI startup(): 119 57526 gmz12.benchmarkcenter.megware.com 119
[0] MPI startup(): 120 57614 gmz12.benchmarkcenter.megware.com 120
[0] MPI startup(): 121 57659 gmz12.benchmarkcenter.megware.com 121
[0] MPI startup(): 122 57530 gmz12.benchmarkcenter.megware.com 122
[0] MPI startup(): 123 57657 gmz12.benchmarkcenter.megware.com 123
[0] MPI startup(): 124 57654 gmz12.benchmarkcenter.megware.com 124
[0] MPI startup(): 125 57508 gmz12.benchmarkcenter.megware.com 125
[0] MPI startup(): 126 57628 gmz12.benchmarkcenter.megware.com 126
[0] MPI startup(): 127 57541 gmz12.benchmarkcenter.megware.com 127
[0] MPI startup(): 128 57591 gmz12.benchmarkcenter.megware.com 128
[0] MPI startup(): 129 57535 gmz12.benchmarkcenter.megware.com 129
[0] MPI startup(): 130 57589 gmz12.benchmarkcenter.megware.com 130
[0] MPI startup(): 131 57669 gmz12.benchmarkcenter.megware.com 131
[0] MPI startup(): 132 57592 gmz12.benchmarkcenter.megware.com 132
[0] MPI startup(): 133 57498 gmz12.benchmarkcenter.megware.com 133
[0] MPI startup(): 134 57544 gmz12.benchmarkcenter.megware.com 134
[0] MPI startup(): 135 57533 gmz12.benchmarkcenter.megware.com 135
[0] MPI startup(): 136 57577 gmz12.benchmarkcenter.megware.com 136
[0] MPI startup(): 137 57637 gmz12.benchmarkcenter.megware.com 137
[0] MPI startup(): 138 57623 gmz12.benchmarkcenter.megware.com 138
[0] MPI startup(): 139 57506 gmz12.benchmarkcenter.megware.com 139
[0] MPI startup(): 140 57661 gmz12.benchmarkcenter.megware.com 140
[0] MPI startup(): 141 57638 gmz12.benchmarkcenter.megware.com 141
[0] MPI startup(): 142 57622 gmz12.benchmarkcenter.megware.com 142
[0] MPI startup(): 143 57595 gmz12.benchmarkcenter.megware.com 143
[0] MPI startup(): 144 57511 gmz12.benchmarkcenter.megware.com 144
[0] MPI startup(): 145 57594 gmz12.benchmarkcenter.megware.com 145
[0] MPI startup(): 146 57512 gmz12.benchmarkcenter.megware.com 146
[0] MPI startup(): 147 57586 gmz12.benchmarkcenter.megware.com 147
[0] MPI startup(): 148 57596 gmz12.benchmarkcenter.megware.com 148
[0] MPI startup(): 149 57543 gmz12.benchmarkcenter.megware.com 149
[0] MPI startup(): 150 57625 gmz12.benchmarkcenter.megware.com 150
[0] MPI startup(): 151 57665 gmz12.benchmarkcenter.megware.com 151
[0] MPI startup(): 152 57579 gmz12.benchmarkcenter.megware.com 152
[0] MPI startup(): 153 57491 gmz12.benchmarkcenter.megware.com 153
[0] MPI startup(): 154 57509 gmz12.benchmarkcenter.megware.com 154
[0] MPI startup(): 155 57500 gmz12.benchmarkcenter.megware.com 155
[0] MPI startup(): 156 57630 gmz12.benchmarkcenter.megware.com 156
[0] MPI startup(): 157 57494 gmz12.benchmarkcenter.megware.com 157
[0] MPI startup(): 158 57510 gmz12.benchmarkcenter.megware.com 158
[0] MPI startup(): 159 57581 gmz12.benchmarkcenter.megware.com 159
[0] MPI startup(): 160 57536 gmz12.benchmarkcenter.megware.com 160
[0] MPI startup(): 161 57583 gmz12.benchmarkcenter.megware.com 161
[0] MPI startup(): 162 57545 gmz12.benchmarkcenter.megware.com 162
[0] MPI startup(): 163 57502 gmz12.benchmarkcenter.megware.com 163
[0] MPI startup(): 164 57627 gmz12.benchmarkcenter.megware.com 164
[0] MPI startup(): 165 57499 gmz12.benchmarkcenter.megware.com 165
[0] MPI startup(): 166 57537 gmz12.benchmarkcenter.megware.com 166
[0] MPI startup(): 167 57660 gmz12.benchmarkcenter.megware.com 167
[0] MPI startup(): 168 57540 gmz12.benchmarkcenter.megware.com 168
[0] MPI startup(): 169 57653 gmz12.benchmarkcenter.megware.com 169
[0] MPI startup(): 170 57663 gmz12.benchmarkcenter.megware.com 170
[0] MPI startup(): 171 57504 gmz12.benchmarkcenter.megware.com 171
[0] MPI startup(): 172 57681 gmz12.benchmarkcenter.megware.com 172
[0] MPI startup(): 173 57662 gmz12.benchmarkcenter.megware.com 173
[0] MPI startup(): 174 57658 gmz12.benchmarkcenter.megware.com 174
[0] MPI startup(): 175 57640 gmz12.benchmarkcenter.megware.com 175
[0] MPI startup(): 176 57501 gmz12.benchmarkcenter.megware.com 176
[0] MPI startup(): 177 57585 gmz12.benchmarkcenter.megware.com 177
[0] MPI startup(): 178 57624 gmz12.benchmarkcenter.megware.com 178
[0] MPI startup(): 179 57656 gmz12.benchmarkcenter.megware.com 179
[0] MPI startup(): 180 57495 gmz12.benchmarkcenter.megware.com 180
[0] MPI startup(): 181 57534 gmz12.benchmarkcenter.megware.com 181
[0] MPI startup(): 182 57666 gmz12.benchmarkcenter.megware.com 182
[0] MPI startup(): 183 57492 gmz12.benchmarkcenter.megware.com 183
[0] MPI startup(): 184 57631 gmz12.benchmarkcenter.megware.com 184
[0] MPI startup(): 185 57538 gmz12.benchmarkcenter.megware.com 185
[0] MPI startup(): 186 57629 gmz12.benchmarkcenter.megware.com 186
[0] MPI startup(): 187 57493 gmz12.benchmarkcenter.megware.com 187
[0] MPI startup(): 188 57505 gmz12.benchmarkcenter.megware.com 188
[0] MPI startup(): 189 57588 gmz12.benchmarkcenter.megware.com 189
[0] MPI startup(): 190 57632 gmz12.benchmarkcenter.megware.com 190
[0] MPI startup(): 191 57539 gmz12.benchmarkcenter.megware.com 191
OMP: pid 57615 tid 57615 thread 0 bound to OS proc set {115}
OMP: pid 57609 tid 57609 thread 0 bound to OS proc set {80}
OMP: pid 57572 tid 57572 thread 0 bound to OS proc set {9}
OMP: pid 57535 tid 57535 thread 0 bound to OS proc set {129}
OMP: pid 57516 tid 57516 thread 0 bound to OS proc set {84}
OMP: pid 57566 tid 57566 thread 0 bound to OS proc set {6}
OMP: pid 57557 tid 57557 thread 0 bound to OS proc set {52}
OMP: pid 57558 tid 57558 thread 0 bound to OS proc set {11}
OMP: pid 57522 tid 57522 thread 0 bound to OS proc set {30}
OMP: pid 57633 tid 57633 thread 0 bound to OS proc set {7}
OMP: pid 57502 tid 57502 thread 0 bound to OS proc set {163}
OMP: pid 57597 tid 57597 thread 0 bound to OS proc set {59}
OMP: pid 57591 tid 57591 thread 0 bound to OS proc set {128}
OMP: pid 57579 tid 57579 thread 0 bound to OS proc set {152}
OMP: pid 57624 tid 57624 thread 0 bound to OS proc set {178}
OMP: pid 57546 tid 57546 thread 0 bound to OS proc set {75}
OMP: pid 57550 tid 57550 thread 0 bound to OS proc set {65}
OMP: pid 57647 tid 57647 thread 0 bound to OS proc set {110}
OMP: pid 57670 tid 57670 thread 0 bound to OS proc set {39}
OMP: pid 57621 tid 57621 thread 0 bound to OS proc set {97}
OMP: pid 57564 tid 57564 thread 0 bound to OS proc set {48}
OMP: pid 57646 tid 57646 thread 0 bound to OS proc set {10}
OMP: pid 57491 tid 57491 thread 0 bound to OS proc set {153}
OMP: pid 57559 tid 57559 thread 0 bound to OS proc set {5}
OMP: pid 57531 tid 57531 thread 0 bound to OS proc set {8}
OMP: pid 57574 tid 57574 thread 0 bound to OS proc set {66}
OMP: pid 57667 tid 57667 thread 0 bound to OS proc set {86}
OMP: pid 57560 tid 57560 thread 0 bound to OS proc set {14}
OMP: pid 57585 tid 57585 thread 0 bound to OS proc set {177}
OMP: pid 57660 tid 57660 thread 0 bound to OS proc set {167}
OMP: pid 57505 tid 57505 thread 0 bound to OS proc set {188}
OMP: pid 57561 tid 57561 thread 0 bound to OS proc set {21}
OMP: pid 57627 tid 57627 thread 0 bound to OS proc set {164}
OMP: pid 57518 tid 57518 thread 0 bound to OS proc set {78}
OMP: pid 57496 tid 57496 thread 0 bound to OS proc set {77}
OMP: pid 57677 tid 57677 thread 0 bound to OS proc set {85}
OMP: pid 57562 tid 57562 thread 0 bound to OS proc set {63}
OMP: pid 57669 tid 57669 thread 0 bound to OS proc set {131}
OMP: pid 57672 tid 57672 thread 0 bound to OS proc set {91}
OMP: pid 57599 tid 57599 thread 0 bound to OS proc set {105}
OMP: pid 57571 tid 57571 thread 0 bound to OS proc set {1}
OMP: pid 57554 tid 57554 thread 0 bound to OS proc set {79}
OMP: pid 57608 tid 57608 thread 0 bound to OS proc set {43}
OMP: pid 57650 tid 57650 thread 0 bound to OS proc set {76}
OMP: pid 57659 tid 57659 thread 0 bound to OS proc set {121}
OMP: pid 57590 tid 57590 thread 0 bound to OS proc set {34}
OMP: pid 57519 tid 57519 thread 0 bound to OS proc set {32}
OMP: pid 57497 tid 57497 thread 0 bound to OS proc set {18}
OMP: pid 57635 tid 57635 thread 0 bound to OS proc set {4}
OMP: pid 57629 tid 57629 thread 0 bound to OS proc set {186}
OMP: pid 57603 tid 57603 thread 0 bound to OS proc set {67}
OMP: pid 57678 tid 57678 thread 0 bound to OS proc set {100}
OMP: pid 57549 tid 57549 thread 0 bound to OS proc set {40}
OMP: pid 57547 tid 57547 thread 0 bound to OS proc set {73}
OMP: pid 57663 tid 57663 thread 0 bound to OS proc set {170}
OMP: pid 57634 tid 57634 thread 0 bound to OS proc set {94}
OMP: pid 57662 tid 57662 thread 0 bound to OS proc set {173}
OMP: pid 57555 tid 57555 thread 0 bound to OS proc set {0}
OMP: pid 57625 tid 57625 thread 0 bound to OS proc set {150}
OMP: pid 57490 tid 57490 thread 0 bound to OS proc set {49}
OMP: pid 57512 tid 57512 thread 0 bound to OS proc set {146}
LAMMPS (22 Jul 2025)
OMP: pid 57600 tid 57600 thread 0 bound to OS proc set {68}
OMP: pid 57594 tid 57594 thread 0 bound to OS proc set {145}
OMP: pid 57500 tid 57500 thread 0 bound to OS proc set {155}
OMP: pid 57665 tid 57665 thread 0 bound to OS proc set {151}
OMP: pid 57664 tid 57664 thread 0 bound to OS proc set {107}
OMP: pid 57653 tid 57653 thread 0 bound to OS proc set {169}
OMP: pid 57551 tid 57551 thread 0 bound to OS proc set {46}
OMP: pid 57671 tid 57671 thread 0 bound to OS proc set {113}
OMP: pid 57521 tid 57521 thread 0 bound to OS proc set {19}
OMP: pid 57681 tid 57681 thread 0 bound to OS proc set {172}
OMP: pid 57655 tid 57655 thread 0 bound to OS proc set {109}
OMP: pid 57628 tid 57628 thread 0 bound to OS proc set {126}
OMP: pid 57606 tid 57606 thread 0 bound to OS proc set {41}
OMP: pid 57536 tid 57536 thread 0 bound to OS proc set {160}
OMP: pid 57520 tid 57520 thread 0 bound to OS proc set {103}
OMP: pid 57530 tid 57530 thread 0 bound to OS proc set {122}
OMP: pid 57676 tid 57676 thread 0 bound to OS proc set {108}
OMP: pid 57539 tid 57539 thread 0 bound to OS proc set {191}
OMP: pid 57631 tid 57631 thread 0 bound to OS proc set {184}
OMP: pid 57568 tid 57568 thread 0 bound to OS proc set {31}
OMP: pid 57587 tid 57587 thread 0 bound to OS proc set {33}
OMP: pid 57569 tid 57569 thread 0 bound to OS proc set {69}
OMP: pid 57601 tid 57601 thread 0 bound to OS proc set {114}
OMP: pid 57675 tid 57675 thread 0 bound to OS proc set {2}
OMP: pid 57648 tid 57648 thread 0 bound to OS proc set {106}
OMP: pid 57578 tid 57578 thread 0 bound to OS proc set {44}
OMP: pid 57540 tid 57540 thread 0 bound to OS proc set {168}
OMP: pid 57526 tid 57526 thread 0 bound to OS proc set {119}
OMP: pid 57499 tid 57499 thread 0 bound to OS proc set {165}
OMP: pid 57619 tid 57619 thread 0 bound to OS proc set {54}
OMP: pid 57630 tid 57630 thread 0 bound to OS proc set {156}
OMP: pid 57602 tid 57602 thread 0 bound to OS proc set {70}
OMP: pid 57493 tid 57493 thread 0 bound to OS proc set {187}
OMP: pid 57517 tid 57517 thread 0 bound to OS proc set {24}
OMP: pid 57529 tid 57529 thread 0 bound to OS proc set {36}
OMP: pid 57525 tid 57525 thread 0 bound to OS proc set {29}
OMP: pid 57610 tid 57610 thread 0 bound to OS proc set {12}
OMP: pid 57622 tid 57622 thread 0 bound to OS proc set {142}
OMP: pid 57636 tid 57636 thread 0 bound to OS proc set {74}
OMP: pid 57644 tid 57644 thread 0 bound to OS proc set {89}
OMP: pid 57538 tid 57538 thread 0 bound to OS proc set {185}
OMP: pid 57668 tid 57668 thread 0 bound to OS proc set {87}
OMP: pid 57596 tid 57596 thread 0 bound to OS proc set {148}
OMP: pid 57548 tid 57548 thread 0 bound to OS proc set {88}
OMP: pid 57613 tid 57613 thread 0 bound to OS proc set {83}
OMP: pid 57511 tid 57511 thread 0 bound to OS proc set {144}
OMP: pid 57495 tid 57495 thread 0 bound to OS proc set {180}
OMP: pid 57563 tid 57563 thread 0 bound to OS proc set {50}
OMP: pid 57576 tid 57576 thread 0 bound to OS proc set {93}
OMP: pid 57632 tid 57632 thread 0 bound to OS proc set {190}
OMP: pid 57523 tid 57523 thread 0 bound to OS proc set {72}
OMP: pid 57649 tid 57649 thread 0 bound to OS proc set {58}
OMP: pid 57674 tid 57674 thread 0 bound to OS proc set {98}
OMP: pid 57527 tid 57527 thread 0 bound to OS proc set {64}
OMP: pid 57498 tid 57498 thread 0 bound to OS proc set {133}
OMP: pid 57654 tid 57654 thread 0 bound to OS proc set {124}
OMP: pid 57623 tid 57623 thread 0 bound to OS proc set {138}
OMP: pid 57641 tid 57641 thread 0 bound to OS proc set {25}
OMP: pid 57503 tid 57503 thread 0 bound to OS proc set {35}
OMP: pid 57637 tid 57637 thread 0 bound to OS proc set {137}
OMP: pid 57639 tid 57639 thread 0 bound to OS proc set {26}
OMP: pid 57533 tid 57533 thread 0 bound to OS proc set {135}
OMP: pid 57652 tid 57652 thread 0 bound to OS proc set {101}
OMP: pid 57598 tid 57598 thread 0 bound to OS proc set {57}
OMP: pid 57552 tid 57552 thread 0 bound to OS proc set {118}
OMP: pid 57651 tid 57651 thread 0 bound to OS proc set {3}
OMP: pid 57543 tid 57543 thread 0 bound to OS proc set {149}
OMP: pid 57658 tid 57658 thread 0 bound to OS proc set {174}
OMP: pid 57513 tid 57513 thread 0 bound to OS proc set {55}
OMP: pid 57492 tid 57492 thread 0 bound to OS proc set {183}
OMP: pid 57592 tid 57592 thread 0 bound to OS proc set {132}
OMP: pid 57640 tid 57640 thread 0 bound to OS proc set {175}
OMP: pid 57642 tid 57642 thread 0 bound to OS proc set {92}
OMP: pid 57584 tid 57584 thread 0 bound to OS proc set {90}
OMP: pid 57586 tid 57586 thread 0 bound to OS proc set {147}
OMP: pid 57645 tid 57645 thread 0 bound to OS proc set {112}
OMP: pid 57577 tid 57577 thread 0 bound to OS proc set {136}
OMP: pid 57575 tid 57575 thread 0 bound to OS proc set {56}
OMP: pid 57528 tid 57528 thread 0 bound to OS proc set {82}
OMP: pid 57542 tid 57542 thread 0 bound to OS proc set {95}
OMP: pid 57604 tid 57604 thread 0 bound to OS proc set {47}
OMP: pid 57583 tid 57583 thread 0 bound to OS proc set {161}
OMP: pid 57657 tid 57657 thread 0 bound to OS proc set {123}
OMP: pid 57656 tid 57656 thread 0 bound to OS proc set {179}
OMP: pid 57534 tid 57534 thread 0 bound to OS proc set {181}
OMP: pid 57508 tid 57508 thread 0 bound to OS proc set {125}
OMP: pid 57532 tid 57532 thread 0 bound to OS proc set {62}
OMP: pid 57617 tid 57617 thread 0 bound to OS proc set {45}
OMP: pid 57611 tid 57611 thread 0 bound to OS proc set {96}
OMP: pid 57507 tid 57507 thread 0 bound to OS proc set {13}
OMP: pid 57581 tid 57581 thread 0 bound to OS proc set {159}
OMP: pid 57612 tid 57612 thread 0 bound to OS proc set {111}
OMP: pid 57570 tid 57570 thread 0 bound to OS proc set {51}
OMP: pid 57673 tid 57673 thread 0 bound to OS proc set {81}
OMP: pid 57626 tid 57626 thread 0 bound to OS proc set {16}
OMP: pid 57682 tid 57682 thread 0 bound to OS proc set {60}
OMP: pid 57605 tid 57605 thread 0 bound to OS proc set {53}
OMP: pid 57593 tid 57593 thread 0 bound to OS proc set {117}
OMP: pid 57524 tid 57524 thread 0 bound to OS proc set {15}
OMP: pid 57661 tid 57661 thread 0 bound to OS proc set {140}
OMP: pid 57544 tid 57544 thread 0 bound to OS proc set {134}
OMP: pid 57501 tid 57501 thread 0 bound to OS proc set {176}
OMP: pid 57582 tid 57582 thread 0 bound to OS proc set {104}
OMP: pid 57589 tid 57589 thread 0 bound to OS proc set {130}
OMP: pid 57643 tid 57643 thread 0 bound to OS proc set {42}
OMP: pid 57515 tid 57515 thread 0 bound to OS proc set {102}
OMP: pid 57595 tid 57595 thread 0 bound to OS proc set {143}
OMP: pid 57607 tid 57607 thread 0 bound to OS proc set {22}
OMP: pid 57510 tid 57510 thread 0 bound to OS proc set {158}
OMP: pid 57567 tid 57567 thread 0 bound to OS proc set {37}
OMP: pid 57588 tid 57588 thread 0 bound to OS proc set {189}
OMP: pid 57580 tid 57580 thread 0 bound to OS proc set {20}
OMP: pid 57565 tid 57565 thread 0 bound to OS proc set {61}
OMP: pid 57616 tid 57616 thread 0 bound to OS proc set {99}
OMP: pid 57556 tid 57556 thread 0 bound to OS proc set {38}
OMP: pid 57506 tid 57506 thread 0 bound to OS proc set {139}
OMP: pid 57638 tid 57638 thread 0 bound to OS proc set {141}
OMP: pid 57573 tid 57573 thread 0 bound to OS proc set {28}
OMP: pid 57509 tid 57509 thread 0 bound to OS proc set {154}
OMP: pid 57537 tid 57537 thread 0 bound to OS proc set {166}
OMP: pid 57514 tid 57514 thread 0 bound to OS proc set {17}
OMP: pid 57666 tid 57666 thread 0 bound to OS proc set {182}
OMP: pid 57545 tid 57545 thread 0 bound to OS proc set {162}
OMP: pid 57679 tid 57679 thread 0 bound to OS proc set {23}
OMP: pid 57618 tid 57618 thread 0 bound to OS proc set {27}
OMP: pid 57620 tid 57620 thread 0 bound to OS proc set {116}
OMP: pid 57541 tid 57541 thread 0 bound to OS proc set {127}
OMP: pid 57504 tid 57504 thread 0 bound to OS proc set {171}
OMP: pid 57553 tid 57553 thread 0 bound to OS proc set {71}
OMP: pid 57494 tid 57494 thread 0 bound to OS proc set {157}
OMP: pid 57614 tid 57614 thread 0 bound to OS proc set {120}
using 1 OpenMP thread(s) per MPI task
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
8 by 4 by 6 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.017 seconds
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam, perpetual
attributes: half, newton on
pair build: half/bin/atomonly/newton
stencil: half/bin/3d
bin: standard
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 68.4 | 69.61 | 70.89 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599872e+08 0 -1.0922177e+08 18704.157
10 475.79342 -1.1121048e+08 0 -1.0919521e+08 64942.612
Loop time of 10.5523 on 192 procs for 10 steps with 32768000 atoms
Performance: 0.409 ns/day, 58.624 hours/ns, 0.948 timesteps/s, 31.053 Matom-step/s
85.7% CPU use with 192 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 6.1525 | 8.5151 | 10.204 | 55.9 | 80.69
Neigh | 0.17214 | 0.17659 | 0.18189 | 0.6 | 1.67
Comm | 0.056502 | 1.7421 | 4.0975 | 123.5 | 16.51
Output | 0.0019397 | 0.0021608 | 0.0026707 | 0.4 | 0.02
Modify | 0.057902 | 0.079235 | 0.089527 | 1.6 | 0.75
Other | | 0.03713 | | | 0.35
Nlocal: 170667 ave 171308 max 169512 min
Histogram: 64 0 0 0 0 0 0 0 13 115
Nghost: 55997.1 ave 56418 max 55762 min
Histogram: 27 61 32 8 0 4 15 27 13 5
Neighs: 6.42419e+06 ave 6.47799e+06 max 6.37962e+06 min
Histogram: 64 0 1 56 7 0 0 0 2 62
Total # of neighbors = 1.2334454e+09
Ave neighs/atom = 37.641767
Neighbor list builds = 1
Dangerous builds = 0
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 68.74 | 69.77 | 70.91 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.79342 -1.1121048e+08 0 -1.0919521e+08 64942.612
50 780.89879 -1.1250694e+08 0 -1.0919937e+08 52278.952
100 798.34164 -1.1258126e+08 0 -1.0919981e+08 51472.994
150 797.64373 -1.1257832e+08 0 -1.0919982e+08 51525.291
200 797.61739 -1.1257821e+08 0 -1.0919983e+08 51537.361
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.084
300 797.68652 -1.125785e+08 0 -1.0919983e+08 51538.828
350 797.80485 -1.12579e+08 0 -1.0919982e+08 51537.471
400 797.7478 -1.1257876e+08 0 -1.0919982e+08 51540.406
450 797.84567 -1.1257917e+08 0 -1.0919982e+08 51536.952
500 797.72463 -1.1257864e+08 0 -1.0919981e+08 51543.012
510 797.68246 -1.1257846e+08 0 -1.091998e+08 51545.168
Loop time of 148.213 on 192 procs for 500 steps with 32768000 atoms
Performance: 1.457 ns/day, 16.468 hours/ns, 3.374 timesteps/s, 110.544 Matom-step/s
97.2% CPU use with 192 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 95.041 | 105.85 | 117.66 | 48.4 | 71.42
Neigh | 15.433 | 16.098 | 21.107 | 29.7 | 10.86
Comm | 6.8962 | 19.472 | 31.615 | 110.9 | 13.14
Output | 0.020432 | 0.022917 | 0.029072 | 1.2 | 0.02
Modify | 2.5416 | 3.2135 | 3.7247 | 14.4 | 2.17
Other | | 3.556 | | | 2.40
Nlocal: 170667 ave 171683 max 169136 min
Histogram: 6 31 24 3 0 0 10 43 59 16
Nghost: 55896.7 ave 56658 max 55273 min
Histogram: 5 9 23 43 36 39 24 7 4 2
Neighs: 6.44217e+06 ave 6.50586e+06 max 6.38063e+06 min
Histogram: 8 36 22 19 34 9 0 10 26 28
Total # of neighbors = 1.2368965e+09
Ave neighs/atom = 37.747084
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:02:57
[MAQAO] Info: 58/192 lprof instances finished
[MAQAO] Info: 95/192 lprof instances finished
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0
To display your profiling results:
####################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
####################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-2578/intel/LAMMPS/run/oneview_runs/defaults/icx/oneview_results_1758034548/tools/lprof_npsu_run_0 #
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