* [MAQAO] Info: Detected 192 Lprof instances in gmz17.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 1064706 gmz17.benchmarkcenter.megware.com 0
[0] MPI startup(): 1 1064821 gmz17.benchmarkcenter.megware.com 1
[0] MPI startup(): 2 1064857 gmz17.benchmarkcenter.megware.com 2
[0] MPI startup(): 3 1064756 gmz17.benchmarkcenter.megware.com 3
[0] MPI startup(): 4 1064780 gmz17.benchmarkcenter.megware.com 4
[0] MPI startup(): 5 1064713 gmz17.benchmarkcenter.megware.com 5
[0] MPI startup(): 6 1064751 gmz17.benchmarkcenter.megware.com 6
[0] MPI startup(): 7 1064795 gmz17.benchmarkcenter.megware.com 7
[0] MPI startup(): 8 1064784 gmz17.benchmarkcenter.megware.com 8
[0] MPI startup(): 9 1064835 gmz17.benchmarkcenter.megware.com 9
[0] MPI startup(): 10 1064799 gmz17.benchmarkcenter.megware.com 10
[0] MPI startup(): 11 1064767 gmz17.benchmarkcenter.megware.com 11
[0] MPI startup(): 12 1064718 gmz17.benchmarkcenter.megware.com 12
[0] MPI startup(): 13 1064746 gmz17.benchmarkcenter.megware.com 13
[0] MPI startup(): 14 1064745 gmz17.benchmarkcenter.megware.com 14
[0] MPI startup(): 15 1064829 gmz17.benchmarkcenter.megware.com 15
[0] MPI startup(): 16 1064716 gmz17.benchmarkcenter.megware.com 16
[0] MPI startup(): 17 1064866 gmz17.benchmarkcenter.megware.com 17
[0] MPI startup(): 18 1064801 gmz17.benchmarkcenter.megware.com 18
[0] MPI startup(): 19 1064877 gmz17.benchmarkcenter.megware.com 19
[0] MPI startup(): 20 1064778 gmz17.benchmarkcenter.megware.com 20
[0] MPI startup(): 21 1064805 gmz17.benchmarkcenter.megware.com 21
[0] MPI startup(): 22 1064748 gmz17.benchmarkcenter.megware.com 22
[0] MPI startup(): 23 1064737 gmz17.benchmarkcenter.megware.com 23
[0] MPI startup(): 24 1064774 gmz17.benchmarkcenter.megware.com 24
[0] MPI startup(): 25 1064895 gmz17.benchmarkcenter.megware.com 25
[0] MPI startup(): 26 1064744 gmz17.benchmarkcenter.megware.com 26
[0] MPI startup(): 27 1064892 gmz17.benchmarkcenter.megware.com 27
[0] MPI startup(): 28 1064747 gmz17.benchmarkcenter.megware.com 28
[0] MPI startup(): 29 1064803 gmz17.benchmarkcenter.megware.com 29
[0] MPI startup(): 30 1064815 gmz17.benchmarkcenter.megware.com 30
[0] MPI startup(): 31 1064762 gmz17.benchmarkcenter.megware.com 31
[0] MPI startup(): 32 1064858 gmz17.benchmarkcenter.megware.com 32
[0] MPI startup(): 33 1064760 gmz17.benchmarkcenter.megware.com 33
[0] MPI startup(): 34 1064712 gmz17.benchmarkcenter.megware.com 34
[0] MPI startup(): 35 1064890 gmz17.benchmarkcenter.megware.com 35
[0] MPI startup(): 36 1064788 gmz17.benchmarkcenter.megware.com 36
[0] MPI startup(): 37 1064763 gmz17.benchmarkcenter.megware.com 37
[0] MPI startup(): 38 1064785 gmz17.benchmarkcenter.megware.com 38
[0] MPI startup(): 39 1064708 gmz17.benchmarkcenter.megware.com 39
[0] MPI startup(): 40 1064826 gmz17.benchmarkcenter.megware.com 40
[0] MPI startup(): 41 1064777 gmz17.benchmarkcenter.megware.com 41
[0] MPI startup(): 42 1064859 gmz17.benchmarkcenter.megware.com 42
[0] MPI startup(): 43 1064769 gmz17.benchmarkcenter.megware.com 43
[0] MPI startup(): 44 1064782 gmz17.benchmarkcenter.megware.com 44
[0] MPI startup(): 45 1064765 gmz17.benchmarkcenter.megware.com 45
[0] MPI startup(): 46 1064766 gmz17.benchmarkcenter.megware.com 46
[0] MPI startup(): 47 1064773 gmz17.benchmarkcenter.megware.com 47
[0] MPI startup(): 48 1064860 gmz17.benchmarkcenter.megware.com 48
[0] MPI startup(): 49 1064809 gmz17.benchmarkcenter.megware.com 49
[0] MPI startup(): 50 1064786 gmz17.benchmarkcenter.megware.com 50
[0] MPI startup(): 51 1064832 gmz17.benchmarkcenter.megware.com 51
[0] MPI startup(): 52 1064856 gmz17.benchmarkcenter.megware.com 52
[0] MPI startup(): 53 1064871 gmz17.benchmarkcenter.megware.com 53
[0] MPI startup(): 54 1064734 gmz17.benchmarkcenter.megware.com 54
[0] MPI startup(): 55 1064787 gmz17.benchmarkcenter.megware.com 55
[0] MPI startup(): 56 1064768 gmz17.benchmarkcenter.megware.com 56
[0] MPI startup(): 57 1064757 gmz17.benchmarkcenter.megware.com 57
[0] MPI startup(): 58 1064707 gmz17.benchmarkcenter.megware.com 58
[0] MPI startup(): 59 1064839 gmz17.benchmarkcenter.megware.com 59
[0] MPI startup(): 60 1064888 gmz17.benchmarkcenter.megware.com 60
[0] MPI startup(): 61 1064740 gmz17.benchmarkcenter.megware.com 61
[0] MPI startup(): 62 1064739 gmz17.benchmarkcenter.megware.com 62
[0] MPI startup(): 63 1064824 gmz17.benchmarkcenter.megware.com 63
[0] MPI startup(): 64 1064802 gmz17.benchmarkcenter.megware.com 64
[0] MPI startup(): 65 1064869 gmz17.benchmarkcenter.megware.com 65
[0] MPI startup(): 66 1064834 gmz17.benchmarkcenter.megware.com 66
[0] MPI startup(): 67 1064781 gmz17.benchmarkcenter.megware.com 67
[0] MPI startup(): 68 1064775 gmz17.benchmarkcenter.megware.com 68
[0] MPI startup(): 69 1064854 gmz17.benchmarkcenter.megware.com 69
[0] MPI startup(): 70 1064735 gmz17.benchmarkcenter.megware.com 70
[0] MPI startup(): 71 1064867 gmz17.benchmarkcenter.megware.com 71
[0] MPI startup(): 72 1064792 gmz17.benchmarkcenter.megware.com 72
[0] MPI startup(): 73 1064855 gmz17.benchmarkcenter.megware.com 73
[0] MPI startup(): 74 1064822 gmz17.benchmarkcenter.megware.com 74
[0] MPI startup(): 75 1064791 gmz17.benchmarkcenter.megware.com 75
[0] MPI startup(): 76 1064717 gmz17.benchmarkcenter.megware.com 76
[0] MPI startup(): 77 1064743 gmz17.benchmarkcenter.megware.com 77
[0] MPI startup(): 78 1064838 gmz17.benchmarkcenter.megware.com 78
[0] MPI startup(): 79 1064836 gmz17.benchmarkcenter.megware.com 79
[0] MPI startup(): 80 1064783 gmz17.benchmarkcenter.megware.com 80
[0] MPI startup(): 81 1064873 gmz17.benchmarkcenter.megware.com 81
[0] MPI startup(): 82 1064719 gmz17.benchmarkcenter.megware.com 82
[0] MPI startup(): 83 1064732 gmz17.benchmarkcenter.megware.com 83
[0] MPI startup(): 84 1064813 gmz17.benchmarkcenter.megware.com 84
[0] MPI startup(): 85 1064742 gmz17.benchmarkcenter.megware.com 85
[0] MPI startup(): 86 1064896 gmz17.benchmarkcenter.megware.com 86
[0] MPI startup(): 87 1064874 gmz17.benchmarkcenter.megware.com 87
[0] MPI startup(): 88 1064808 gmz17.benchmarkcenter.megware.com 88
[0] MPI startup(): 89 1064721 gmz17.benchmarkcenter.megware.com 89
[0] MPI startup(): 90 1064723 gmz17.benchmarkcenter.megware.com 90
[0] MPI startup(): 91 1064864 gmz17.benchmarkcenter.megware.com 91
[0] MPI startup(): 92 1064804 gmz17.benchmarkcenter.megware.com 92
[0] MPI startup(): 93 1064880 gmz17.benchmarkcenter.megware.com 93
[0] MPI startup(): 94 1064876 gmz17.benchmarkcenter.megware.com 94
[0] MPI startup(): 95 1064759 gmz17.benchmarkcenter.megware.com 95
[0] MPI startup(): 96 1064715 gmz17.benchmarkcenter.megware.com 96
[0] MPI startup(): 97 1064841 gmz17.benchmarkcenter.megware.com 97
[0] MPI startup(): 98 1064850 gmz17.benchmarkcenter.megware.com 98
[0] MPI startup(): 99 1064831 gmz17.benchmarkcenter.megware.com 99
[0] MPI startup(): 100 1064893 gmz17.benchmarkcenter.megware.com 100
[0] MPI startup(): 101 1064847 gmz17.benchmarkcenter.megware.com 101
[0] MPI startup(): 102 1064729 gmz17.benchmarkcenter.megware.com 102
[0] MPI startup(): 103 1064794 gmz17.benchmarkcenter.megware.com 103
[0] MPI startup(): 104 1064730 gmz17.benchmarkcenter.megware.com 104
[0] MPI startup(): 105 1064761 gmz17.benchmarkcenter.megware.com 105
[0] MPI startup(): 106 1064800 gmz17.benchmarkcenter.megware.com 106
[0] MPI startup(): 107 1064733 gmz17.benchmarkcenter.megware.com 107
[0] MPI startup(): 108 1064823 gmz17.benchmarkcenter.megware.com 108
[0] MPI startup(): 109 1064722 gmz17.benchmarkcenter.megware.com 109
[0] MPI startup(): 110 1064865 gmz17.benchmarkcenter.megware.com 110
[0] MPI startup(): 111 1064885 gmz17.benchmarkcenter.megware.com 111
[0] MPI startup(): 112 1064851 gmz17.benchmarkcenter.megware.com 112
[0] MPI startup(): 113 1064879 gmz17.benchmarkcenter.megware.com 113
[0] MPI startup(): 114 1064825 gmz17.benchmarkcenter.megware.com 114
[0] MPI startup(): 115 1064878 gmz17.benchmarkcenter.megware.com 115
[0] MPI startup(): 116 1064894 gmz17.benchmarkcenter.megware.com 116
[0] MPI startup(): 117 1064789 gmz17.benchmarkcenter.megware.com 117
[0] MPI startup(): 118 1064714 gmz17.benchmarkcenter.megware.com 118
[0] MPI startup(): 119 1064868 gmz17.benchmarkcenter.megware.com 119
[0] MPI startup(): 120 1064736 gmz17.benchmarkcenter.megware.com 120
[0] MPI startup(): 121 1064764 gmz17.benchmarkcenter.megware.com 121
[0] MPI startup(): 122 1064819 gmz17.benchmarkcenter.megware.com 122
[0] MPI startup(): 123 1064842 gmz17.benchmarkcenter.megware.com 123
[0] MPI startup(): 124 1064852 gmz17.benchmarkcenter.megware.com 124
[0] MPI startup(): 125 1064772 gmz17.benchmarkcenter.megware.com 125
[0] MPI startup(): 126 1064820 gmz17.benchmarkcenter.megware.com 126
[0] MPI startup(): 127 1064870 gmz17.benchmarkcenter.megware.com 127
[0] MPI startup(): 128 1064817 gmz17.benchmarkcenter.megware.com 128
[0] MPI startup(): 129 1064897 gmz17.benchmarkcenter.megware.com 129
[0] MPI startup(): 130 1064720 gmz17.benchmarkcenter.megware.com 130
[0] MPI startup(): 131 1064711 gmz17.benchmarkcenter.megware.com 131
[0] MPI startup(): 132 1064818 gmz17.benchmarkcenter.megware.com 132
[0] MPI startup(): 133 1064806 gmz17.benchmarkcenter.megware.com 133
[0] MPI startup(): 134 1064755 gmz17.benchmarkcenter.megware.com 134
[0] MPI startup(): 135 1064776 gmz17.benchmarkcenter.megware.com 135
[0] MPI startup(): 136 1064837 gmz17.benchmarkcenter.megware.com 136
[0] MPI startup(): 137 1064883 gmz17.benchmarkcenter.megware.com 137
[0] MPI startup(): 138 1064886 gmz17.benchmarkcenter.megware.com 138
[0] MPI startup(): 139 1064726 gmz17.benchmarkcenter.megware.com 139
[0] MPI startup(): 140 1064749 gmz17.benchmarkcenter.megware.com 140
[0] MPI startup(): 141 1064727 gmz17.benchmarkcenter.megware.com 141
[0] MPI startup(): 142 1064884 gmz17.benchmarkcenter.megware.com 142
[0] MPI startup(): 143 1064754 gmz17.benchmarkcenter.megware.com 143
[0] MPI startup(): 144 1064790 gmz17.benchmarkcenter.megware.com 144
[0] MPI startup(): 145 1064861 gmz17.benchmarkcenter.megware.com 145
[0] MPI startup(): 146 1064830 gmz17.benchmarkcenter.megware.com 146
[0] MPI startup(): 147 1064709 gmz17.benchmarkcenter.megware.com 147
[0] MPI startup(): 148 1064752 gmz17.benchmarkcenter.megware.com 148
[0] MPI startup(): 149 1064753 gmz17.benchmarkcenter.megware.com 149
[0] MPI startup(): 150 1064797 gmz17.benchmarkcenter.megware.com 150
[0] MPI startup(): 151 1064816 gmz17.benchmarkcenter.megware.com 151
[0] MPI startup(): 152 1064862 gmz17.benchmarkcenter.megware.com 152
[0] MPI startup(): 153 1064840 gmz17.benchmarkcenter.megware.com 153
[0] MPI startup(): 154 1064891 gmz17.benchmarkcenter.megware.com 154
[0] MPI startup(): 155 1064846 gmz17.benchmarkcenter.megware.com 155
[0] MPI startup(): 156 1064814 gmz17.benchmarkcenter.megware.com 156
[0] MPI startup(): 157 1064779 gmz17.benchmarkcenter.megware.com 157
[0] MPI startup(): 158 1064728 gmz17.benchmarkcenter.megware.com 158
[0] MPI startup(): 159 1064881 gmz17.benchmarkcenter.megware.com 159
[0] MPI startup(): 160 1064848 gmz17.benchmarkcenter.megware.com 160
[0] MPI startup(): 161 1064828 gmz17.benchmarkcenter.megware.com 161
[0] MPI startup(): 162 1064724 gmz17.benchmarkcenter.megware.com 162
[0] MPI startup(): 163 1064853 gmz17.benchmarkcenter.megware.com 163
[0] MPI startup(): 164 1064872 gmz17.benchmarkcenter.megware.com 164
[0] MPI startup(): 165 1064812 gmz17.benchmarkcenter.megware.com 165
[0] MPI startup(): 166 1064738 gmz17.benchmarkcenter.megware.com 166
[0] MPI startup(): 167 1064845 gmz17.benchmarkcenter.megware.com 167
[0] MPI startup(): 168 1064758 gmz17.benchmarkcenter.megware.com 168
[0] MPI startup(): 169 1064807 gmz17.benchmarkcenter.megware.com 169
[0] MPI startup(): 170 1064798 gmz17.benchmarkcenter.megware.com 170
[0] MPI startup(): 171 1064863 gmz17.benchmarkcenter.megware.com 171
[0] MPI startup(): 172 1064833 gmz17.benchmarkcenter.megware.com 172
[0] MPI startup(): 173 1064741 gmz17.benchmarkcenter.megware.com 173
[0] MPI startup(): 174 1064725 gmz17.benchmarkcenter.megware.com 174
[0] MPI startup(): 175 1064849 gmz17.benchmarkcenter.megware.com 175
[0] MPI startup(): 176 1064875 gmz17.benchmarkcenter.megware.com 176
[0] MPI startup(): 177 1064731 gmz17.benchmarkcenter.megware.com 177
[0] MPI startup(): 178 1064887 gmz17.benchmarkcenter.megware.com 178
[0] MPI startup(): 179 1064710 gmz17.benchmarkcenter.megware.com 179
[0] MPI startup(): 180 1064793 gmz17.benchmarkcenter.megware.com 180
[0] MPI startup(): 181 1064843 gmz17.benchmarkcenter.megware.com 181
[0] MPI startup(): 182 1064750 gmz17.benchmarkcenter.megware.com 182
[0] MPI startup(): 183 1064882 gmz17.benchmarkcenter.megware.com 183
[0] MPI startup(): 184 1064810 gmz17.benchmarkcenter.megware.com 184
[0] MPI startup(): 185 1064827 gmz17.benchmarkcenter.megware.com 185
[0] MPI startup(): 186 1064771 gmz17.benchmarkcenter.megware.com 186
[0] MPI startup(): 187 1064844 gmz17.benchmarkcenter.megware.com 187
[0] MPI startup(): 188 1064796 gmz17.benchmarkcenter.megware.com 188
[0] MPI startup(): 189 1064770 gmz17.benchmarkcenter.megware.com 189
[0] MPI startup(): 190 1064889 gmz17.benchmarkcenter.megware.com 190
[0] MPI startup(): 191 1064811 gmz17.benchmarkcenter.megware.com 191
OMP: pid 1064843 tid 1064843 thread 0 bound to OS proc set {181}
OMP: pid 1064794 tid 1064794 thread 0 bound to OS proc set {103}
OMP: pid 1064730 tid 1064730 thread 0 bound to OS proc set {104}
OMP: pid 1064712 tid 1064712 thread 0 bound to OS proc set {34}
OMP: pid 1064761 tid 1064761 thread 0 bound to OS proc set {105}
OMP: pid 1064842 tid 1064842 thread 0 bound to OS proc set {123}
OMP: pid 1064734 tid 1064734 thread 0 bound to OS proc set {54}
OMP: pid 1064835 tid 1064835 thread 0 bound to OS proc set {9}
OMP: pid 1064832 tid 1064832 thread 0 bound to OS proc set {51}
OMP: pid 1064754 tid 1064754 thread 0 bound to OS proc set {143}
OMP: pid 1064813 tid 1064813 thread 0 bound to OS proc set {84}
OMP: pid 1064836 tid 1064836 thread 0 bound to OS proc set {79}
OMP: pid 1064878 tid 1064878 thread 0 bound to OS proc set {115}
OMP: pid 1064719 tid 1064719 thread 0 bound to OS proc set {82}
OMP: pid 1064829 tid 1064829 thread 0 bound to OS proc set {15}
OMP: pid 1064707 tid 1064707 thread 0 bound to OS proc set {58}
OMP: pid 1064757 tid 1064757 thread 0 bound to OS proc set {57}
OMP: pid 1064709 tid 1064709 thread 0 bound to OS proc set {147}
OMP: pid 1064745 tid 1064745 thread 0 bound to OS proc set {14}
OMP: pid 1064737 tid 1064737 thread 0 bound to OS proc set {23}
OMP: pid 1064812 tid 1064812 thread 0 bound to OS proc set {165}
OMP: pid 1064866 tid 1064866 thread 0 bound to OS proc set {17}
OMP: pid 1064803 tid 1064803 thread 0 bound to OS proc set {29}
OMP: pid 1064710 tid 1064710 thread 0 bound to OS proc set {179}
OMP: pid 1064784 tid 1064784 thread 0 bound to OS proc set {8}
OMP: pid 1064848 tid 1064848 thread 0 bound to OS proc set {160}
OMP: pid 1064806 tid 1064806 thread 0 bound to OS proc set {133}
OMP: pid 1064765 tid 1064765 thread 0 bound to OS proc set {45}
OMP: pid 1064772 tid 1064772 thread 0 bound to OS proc set {125}
OMP: pid 1064821 tid 1064821 thread 0 bound to OS proc set {1}
OMP: pid 1064744 tid 1064744 thread 0 bound to OS proc set {26}
OMP: pid 1064887 tid 1064887 thread 0 bound to OS proc set {178}
OMP: pid 1064711 tid 1064711 thread 0 bound to OS proc set {131}
OMP: pid 1064872 tid 1064872 thread 0 bound to OS proc set {164}
OMP: pid 1064865 tid 1064865 thread 0 bound to OS proc set {110}
OMP: pid 1064854 tid 1064854 thread 0 bound to OS proc set {69}
OMP: pid 1064804 tid 1064804 thread 0 bound to OS proc set {92}
OMP: pid 1064862 tid 1064862 thread 0 bound to OS proc set {152}
OMP: pid 1064830 tid 1064830 thread 0 bound to OS proc set {146}
OMP: pid 1064863 tid 1064863 thread 0 bound to OS proc set {171}
OMP: pid 1064764 tid 1064764 thread 0 bound to OS proc set {121}
OMP: pid 1064807 tid 1064807 thread 0 bound to OS proc set {169}
OMP: pid 1064858 tid 1064858 thread 0 bound to OS proc set {32}
OMP: pid 1064791 tid 1064791 thread 0 bound to OS proc set {75}
OMP: pid 1064799 tid 1064799 thread 0 bound to OS proc set {10}
OMP: pid 1064713 tid 1064713 thread 0 bound to OS proc set {5}
OMP: pid 1064714 tid 1064714 thread 0 bound to OS proc set {118}
OMP: pid 1064706 tid 1064706 thread 0 bound to OS proc set {0}
OMP: pid 1064778 tid 1064778 thread 0 bound to OS proc set {20}
LAMMPS (22 Jul 2025)
OMP: pid 1064867 tid 1064867 thread 0 bound to OS proc set {71}
OMP: pid 1064785 tid 1064785 thread 0 bound to OS proc set {38}
OMP: pid 1064773 tid 1064773 thread 0 bound to OS proc set {47}
OMP: pid 1064883 tid 1064883 thread 0 bound to OS proc set {137}
OMP: pid 1064724 tid 1064724 thread 0 bound to OS proc set {162}
OMP: pid 1064742 tid 1064742 thread 0 bound to OS proc set {85}
OMP: pid 1064746 tid 1064746 thread 0 bound to OS proc set {13}
OMP: pid 1064789 tid 1064789 thread 0 bound to OS proc set {117}
OMP: pid 1064788 tid 1064788 thread 0 bound to OS proc set {36}
OMP: pid 1064782 tid 1064782 thread 0 bound to OS proc set {44}
OMP: pid 1064783 tid 1064783 thread 0 bound to OS proc set {80}
OMP: pid 1064771 tid 1064771 thread 0 bound to OS proc set {186}
OMP: pid 1064725 tid 1064725 thread 0 bound to OS proc set {174}
OMP: pid 1064845 tid 1064845 thread 0 bound to OS proc set {167}
OMP: pid 1064758 tid 1064758 thread 0 bound to OS proc set {168}
OMP: pid 1064743 tid 1064743 thread 0 bound to OS proc set {77}
OMP: pid 1064880 tid 1064880 thread 0 bound to OS proc set {93}
OMP: pid 1064874 tid 1064874 thread 0 bound to OS proc set {87}
OMP: pid 1064728 tid 1064728 thread 0 bound to OS proc set {158}
OMP: pid 1064776 tid 1064776 thread 0 bound to OS proc set {135}
OMP: pid 1064770 tid 1064770 thread 0 bound to OS proc set {189}
OMP: pid 1064774 tid 1064774 thread 0 bound to OS proc set {24}
OMP: pid 1064751 tid 1064751 thread 0 bound to OS proc set {6}
OMP: pid 1064722 tid 1064722 thread 0 bound to OS proc set {109}
OMP: pid 1064721 tid 1064721 thread 0 bound to OS proc set {89}
OMP: pid 1064723 tid 1064723 thread 0 bound to OS proc set {90}
OMP: pid 1064798 tid 1064798 thread 0 bound to OS proc set {170}
OMP: pid 1064727 tid 1064727 thread 0 bound to OS proc set {141}
OMP: pid 1064849 tid 1064849 thread 0 bound to OS proc set {175}
OMP: pid 1064819 tid 1064819 thread 0 bound to OS proc set {122}
OMP: pid 1064729 tid 1064729 thread 0 bound to OS proc set {102}
OMP: pid 1064847 tid 1064847 thread 0 bound to OS proc set {101}
OMP: pid 1064853 tid 1064853 thread 0 bound to OS proc set {163}
OMP: pid 1064748 tid 1064748 thread 0 bound to OS proc set {22}
OMP: pid 1064736 tid 1064736 thread 0 bound to OS proc set {120}
OMP: pid 1064735 tid 1064735 thread 0 bound to OS proc set {70}
OMP: pid 1064890 tid 1064890 thread 0 bound to OS proc set {35}
OMP: pid 1064756 tid 1064756 thread 0 bound to OS proc set {3}
OMP: pid 1064877 tid 1064877 thread 0 bound to OS proc set {19}
OMP: pid 1064796 tid 1064796 thread 0 bound to OS proc set {188}
OMP: pid 1064808 tid 1064808 thread 0 bound to OS proc set {88}
OMP: pid 1064825 tid 1064825 thread 0 bound to OS proc set {114}
OMP: pid 1064741 tid 1064741 thread 0 bound to OS proc set {173}
OMP: pid 1064891 tid 1064891 thread 0 bound to OS proc set {154}
OMP: pid 1064839 tid 1064839 thread 0 bound to OS proc set {59}
OMP: pid 1064870 tid 1064870 thread 0 bound to OS proc set {127}
OMP: pid 1064822 tid 1064822 thread 0 bound to OS proc set {74}
OMP: pid 1064731 tid 1064731 thread 0 bound to OS proc set {177}
OMP: pid 1064786 tid 1064786 thread 0 bound to OS proc set {50}
OMP: pid 1064802 tid 1064802 thread 0 bound to OS proc set {64}
OMP: pid 1064805 tid 1064805 thread 0 bound to OS proc set {21}
OMP: pid 1064777 tid 1064777 thread 0 bound to OS proc set {41}
OMP: pid 1064801 tid 1064801 thread 0 bound to OS proc set {18}
OMP: pid 1064856 tid 1064856 thread 0 bound to OS proc set {52}
OMP: pid 1064844 tid 1064844 thread 0 bound to OS proc set {187}
OMP: pid 1064859 tid 1064859 thread 0 bound to OS proc set {42}
OMP: pid 1064840 tid 1064840 thread 0 bound to OS proc set {153}
OMP: pid 1064797 tid 1064797 thread 0 bound to OS proc set {150}
OMP: pid 1064864 tid 1064864 thread 0 bound to OS proc set {91}
OMP: pid 1064815 tid 1064815 thread 0 bound to OS proc set {30}
OMP: pid 1064767 tid 1064767 thread 0 bound to OS proc set {11}
OMP: pid 1064882 tid 1064882 thread 0 bound to OS proc set {183}
OMP: pid 1064868 tid 1064868 thread 0 bound to OS proc set {119}
OMP: pid 1064793 tid 1064793 thread 0 bound to OS proc set {180}
OMP: pid 1064860 tid 1064860 thread 0 bound to OS proc set {48}
OMP: pid 1064733 tid 1064733 thread 0 bound to OS proc set {107}
OMP: pid 1064768 tid 1064768 thread 0 bound to OS proc set {56}
OMP: pid 1064851 tid 1064851 thread 0 bound to OS proc set {112}
OMP: pid 1064716 tid 1064716 thread 0 bound to OS proc set {16}
OMP: pid 1064817 tid 1064817 thread 0 bound to OS proc set {128}
OMP: pid 1064827 tid 1064827 thread 0 bound to OS proc set {185}
OMP: pid 1064749 tid 1064749 thread 0 bound to OS proc set {140}
OMP: pid 1064739 tid 1064739 thread 0 bound to OS proc set {62}
OMP: pid 1064824 tid 1064824 thread 0 bound to OS proc set {63}
OMP: pid 1064885 tid 1064885 thread 0 bound to OS proc set {111}
OMP: pid 1064857 tid 1064857 thread 0 bound to OS proc set {2}
OMP: pid 1064834 tid 1064834 thread 0 bound to OS proc set {66}
OMP: pid 1064879 tid 1064879 thread 0 bound to OS proc set {113}
OMP: pid 1064787 tid 1064787 thread 0 bound to OS proc set {55}
OMP: pid 1064889 tid 1064889 thread 0 bound to OS proc set {190}
OMP: pid 1064855 tid 1064855 thread 0 bound to OS proc set {73}
OMP: pid 1064750 tid 1064750 thread 0 bound to OS proc set {182}
OMP: pid 1064852 tid 1064852 thread 0 bound to OS proc set {124}
OMP: pid 1064828 tid 1064828 thread 0 bound to OS proc set {161}
OMP: pid 1064800 tid 1064800 thread 0 bound to OS proc set {106}
OMP: pid 1064810 tid 1064810 thread 0 bound to OS proc set {184}
OMP: pid 1064747 tid 1064747 thread 0 bound to OS proc set {28}
OMP: pid 1064755 tid 1064755 thread 0 bound to OS proc set {134}
OMP: pid 1064769 tid 1064769 thread 0 bound to OS proc set {43}
OMP: pid 1064792 tid 1064792 thread 0 bound to OS proc set {72}
OMP: pid 1064846 tid 1064846 thread 0 bound to OS proc set {155}
OMP: pid 1064820 tid 1064820 thread 0 bound to OS proc set {126}
OMP: pid 1064881 tid 1064881 thread 0 bound to OS proc set {159}
OMP: pid 1064760 tid 1064760 thread 0 bound to OS proc set {33}
OMP: pid 1064826 tid 1064826 thread 0 bound to OS proc set {40}
OMP: pid 1064738 tid 1064738 thread 0 bound to OS proc set {166}
OMP: pid 1064759 tid 1064759 thread 0 bound to OS proc set {95}
OMP: pid 1064886 tid 1064886 thread 0 bound to OS proc set {138}
OMP: pid 1064752 tid 1064752 thread 0 bound to OS proc set {148}
OMP: pid 1064717 tid 1064717 thread 0 bound to OS proc set {76}
OMP: pid 1064888 tid 1064888 thread 0 bound to OS proc set {60}
OMP: pid 1064779 tid 1064779 thread 0 bound to OS proc set {157}
OMP: pid 1064875 tid 1064875 thread 0 bound to OS proc set {176}
OMP: pid 1064897 tid 1064897 thread 0 bound to OS proc set {129}
OMP: pid 1064841 tid 1064841 thread 0 bound to OS proc set {97}
OMP: pid 1064762 tid 1064762 thread 0 bound to OS proc set {31}
OMP: pid 1064763 tid 1064763 thread 0 bound to OS proc set {37}
OMP: pid 1064896 tid 1064896 thread 0 bound to OS proc set {86}
OMP: pid 1064814 tid 1064814 thread 0 bound to OS proc set {156}
OMP: pid 1064811 tid 1064811 thread 0 bound to OS proc set {191}
OMP: pid 1064876 tid 1064876 thread 0 bound to OS proc set {94}
OMP: pid 1064861 tid 1064861 thread 0 bound to OS proc set {145}
OMP: pid 1064809 tid 1064809 thread 0 bound to OS proc set {49}
OMP: pid 1064715 tid 1064715 thread 0 bound to OS proc set {96}
OMP: pid 1064718 tid 1064718 thread 0 bound to OS proc set {12}
OMP: pid 1064833 tid 1064833 thread 0 bound to OS proc set {172}
OMP: pid 1064871 tid 1064871 thread 0 bound to OS proc set {53}
OMP: pid 1064816 tid 1064816 thread 0 bound to OS proc set {151}
OMP: pid 1064850 tid 1064850 thread 0 bound to OS proc set {98}
OMP: pid 1064892 tid 1064892 thread 0 bound to OS proc set {27}
OMP: pid 1064894 tid 1064894 thread 0 bound to OS proc set {116}
OMP: pid 1064766 tid 1064766 thread 0 bound to OS proc set {46}
OMP: pid 1064795 tid 1064795 thread 0 bound to OS proc set {7}
OMP: pid 1064775 tid 1064775 thread 0 bound to OS proc set {68}
OMP: pid 1064780 tid 1064780 thread 0 bound to OS proc set {4}
OMP: pid 1064708 tid 1064708 thread 0 bound to OS proc set {39}
OMP: pid 1064837 tid 1064837 thread 0 bound to OS proc set {136}
OMP: pid 1064790 tid 1064790 thread 0 bound to OS proc set {144}
OMP: pid 1064823 tid 1064823 thread 0 bound to OS proc set {108}
OMP: pid 1064726 tid 1064726 thread 0 bound to OS proc set {139}
OMP: pid 1064873 tid 1064873 thread 0 bound to OS proc set {81}
OMP: pid 1064831 tid 1064831 thread 0 bound to OS proc set {99}
OMP: pid 1064869 tid 1064869 thread 0 bound to OS proc set {65}
OMP: pid 1064893 tid 1064893 thread 0 bound to OS proc set {100}
OMP: pid 1064781 tid 1064781 thread 0 bound to OS proc set {67}
OMP: pid 1064720 tid 1064720 thread 0 bound to OS proc set {130}
OMP: pid 1064884 tid 1064884 thread 0 bound to OS proc set {142}
OMP: pid 1064753 tid 1064753 thread 0 bound to OS proc set {149}
OMP: pid 1064732 tid 1064732 thread 0 bound to OS proc set {83}
OMP: pid 1064818 tid 1064818 thread 0 bound to OS proc set {132}
OMP: pid 1064895 tid 1064895 thread 0 bound to OS proc set {25}
OMP: pid 1064740 tid 1064740 thread 0 bound to OS proc set {61}
OMP: pid 1064838 tid 1064838 thread 0 bound to OS proc set {78}
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 = 0.016 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Clang C++ AMD Clang 17.0.6 (CLANG: AOCC_5.0.0-Build#1377 2024_09_24)
SIMD compiler directives: Disabled
Precision: mixed
----------------------------------------------------------
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/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1445 | 1490 | 1544 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18704.016
10 475.79341 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 1.14199 on 192 procs for 10 steps with 32768000 atoms
Performance: 3.783 ns/day, 6.344 hours/ns, 8.757 timesteps/s, 286.937 Matom-step/s
98.8% CPU use with 192 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.88527 | 0.90027 | 0.92258 | 0.7 | 78.83
Neigh | 0.040937 | 0.045044 | 0.04732 | 0.5 | 3.94
Comm | 0.072333 | 0.086633 | 0.10727 | 2.5 | 7.59
Output | 0.0015406 | 0.0020384 | 0.0053142 | 1.1 | 0.18
Modify | 0.06353 | 0.076604 | 0.086013 | 1.8 | 6.71
Other | | 0.03141 | | | 2.75
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: 6.4242e+06 ave 6.47799e+06 max 6.37962e+06 min
Histogram: 64 0 1 56 7 0 0 0 2 62
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Clang C++ AMD Clang 17.0.6 (CLANG: AOCC_5.0.0-Build#1377 2024_09_24)
SIMD compiler directives: Disabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1445 | 1490 | 1544 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.79341 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89877 -1.1250693e+08 0 -1.0919936e+08 52278.946
100 798.34168 -1.1258126e+08 0 -1.0919981e+08 51472.983
150 797.64373 -1.1257832e+08 0 -1.0919982e+08 51525.285
200 797.61744 -1.1257821e+08 0 -1.0919982e+08 51537.359
250 797.85511 -1.1257922e+08 0 -1.0919983e+08 51529.084
300 797.68663 -1.125785e+08 0 -1.0919982e+08 51538.822
350 797.80505 -1.12579e+08 0 -1.0919982e+08 51537.472
400 797.74788 -1.1257875e+08 0 -1.0919981e+08 51540.403
450 797.84597 -1.1257917e+08 0 -1.0919981e+08 51536.945
500 797.72404 -1.1257864e+08 0 -1.091998e+08 51543.036
510 797.6829 -1.1257846e+08 0 -1.091998e+08 51545.142
Loop time of 79.7825 on 192 procs for 500 steps with 32768000 atoms
Performance: 2.707 ns/day, 8.865 hours/ns, 6.267 timesteps/s, 205.358 Matom-step/s
99.1% CPU use with 192 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 65.156 | 65.695 | 66.421 | 3.0 | 82.34
Neigh | 3.6974 | 3.8299 | 3.9269 | 2.8 | 4.80
Comm | 4.2713 | 5.1211 | 6.5499 | 21.7 | 6.42
Output | 0.017153 | 0.026542 | 0.04888 | 4.2 | 0.03
Modify | 2.4692 | 3.7614 | 4.2787 | 16.8 | 4.71
Other | | 1.349 | | | 1.69
Nlocal: 170667 ave 171683 max 169136 min
Histogram: 6 31 24 3 0 0 10 44 58 16
Nghost: 55896.5 ave 56660 max 55273 min
Histogram: 5 9 23 43 37 38 24 7 4 2
Neighs: 6.44217e+06 ave 6.50574e+06 max 6.38064e+06 min
Histogram: 8 36 21 20 34 9 0 10 26 28
Total # of neighbors = 1.2368964e+09
Ave neighs/atom = 37.747083
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:01:21
[MAQAO] Info: 67/192 lprof instances finished
[MAQAO] Info: 73/192 lprof instances finished
[MAQAO] Info: 191/192 lprof instances finished
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0
To display your profiling results:
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# LEVEL | REPORT | COMMAND #
########################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/compilers/aocc_2/oneview_results_1758144982/tools/lprof_npsu_run_0 #
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