* [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 745845 gmz17.benchmarkcenter.megware.com 0
[0] MPI startup(): 1 745785 gmz17.benchmarkcenter.megware.com 1
[0] MPI startup(): 2 745788 gmz17.benchmarkcenter.megware.com 2
[0] MPI startup(): 3 745910 gmz17.benchmarkcenter.megware.com 3
[0] MPI startup(): 4 745879 gmz17.benchmarkcenter.megware.com 4
[0] MPI startup(): 5 745907 gmz17.benchmarkcenter.megware.com 5
[0] MPI startup(): 6 745796 gmz17.benchmarkcenter.megware.com 6
[0] MPI startup(): 7 745754 gmz17.benchmarkcenter.megware.com 7
[0] MPI startup(): 8 745872 gmz17.benchmarkcenter.megware.com 8
[0] MPI startup(): 9 745793 gmz17.benchmarkcenter.megware.com 9
[0] MPI startup(): 10 745744 gmz17.benchmarkcenter.megware.com 10
[0] MPI startup(): 11 745876 gmz17.benchmarkcenter.megware.com 11
[0] MPI startup(): 12 745809 gmz17.benchmarkcenter.megware.com 12
[0] MPI startup(): 13 745784 gmz17.benchmarkcenter.megware.com 13
[0] MPI startup(): 14 745912 gmz17.benchmarkcenter.megware.com 14
[0] MPI startup(): 15 745745 gmz17.benchmarkcenter.megware.com 15
[0] MPI startup(): 16 745789 gmz17.benchmarkcenter.megware.com 16
[0] MPI startup(): 17 745865 gmz17.benchmarkcenter.megware.com 17
[0] MPI startup(): 18 745795 gmz17.benchmarkcenter.megware.com 18
[0] MPI startup(): 19 745758 gmz17.benchmarkcenter.megware.com 19
[0] MPI startup(): 20 745911 gmz17.benchmarkcenter.megware.com 20
[0] MPI startup(): 21 745848 gmz17.benchmarkcenter.megware.com 21
[0] MPI startup(): 22 745803 gmz17.benchmarkcenter.megware.com 22
[0] MPI startup(): 23 745909 gmz17.benchmarkcenter.megware.com 23
[0] MPI startup(): 24 745750 gmz17.benchmarkcenter.megware.com 24
[0] MPI startup(): 25 745797 gmz17.benchmarkcenter.megware.com 25
[0] MPI startup(): 26 745808 gmz17.benchmarkcenter.megware.com 26
[0] MPI startup(): 27 745794 gmz17.benchmarkcenter.megware.com 27
[0] MPI startup(): 28 745852 gmz17.benchmarkcenter.megware.com 28
[0] MPI startup(): 29 745742 gmz17.benchmarkcenter.megware.com 29
[0] MPI startup(): 30 745751 gmz17.benchmarkcenter.megware.com 30
[0] MPI startup(): 31 745830 gmz17.benchmarkcenter.megware.com 31
[0] MPI startup(): 32 745792 gmz17.benchmarkcenter.megware.com 32
[0] MPI startup(): 33 745838 gmz17.benchmarkcenter.megware.com 33
[0] MPI startup(): 34 745842 gmz17.benchmarkcenter.megware.com 34
[0] MPI startup(): 35 745886 gmz17.benchmarkcenter.megware.com 35
[0] MPI startup(): 36 745851 gmz17.benchmarkcenter.megware.com 36
[0] MPI startup(): 37 745746 gmz17.benchmarkcenter.megware.com 37
[0] MPI startup(): 38 745929 gmz17.benchmarkcenter.megware.com 38
[0] MPI startup(): 39 745791 gmz17.benchmarkcenter.megware.com 39
[0] MPI startup(): 40 745853 gmz17.benchmarkcenter.megware.com 40
[0] MPI startup(): 41 745869 gmz17.benchmarkcenter.megware.com 41
[0] MPI startup(): 42 745884 gmz17.benchmarkcenter.megware.com 42
[0] MPI startup(): 43 745890 gmz17.benchmarkcenter.megware.com 43
[0] MPI startup(): 44 745908 gmz17.benchmarkcenter.megware.com 44
[0] MPI startup(): 45 745847 gmz17.benchmarkcenter.megware.com 45
[0] MPI startup(): 46 745832 gmz17.benchmarkcenter.megware.com 46
[0] MPI startup(): 47 745839 gmz17.benchmarkcenter.megware.com 47
[0] MPI startup(): 48 745905 gmz17.benchmarkcenter.megware.com 48
[0] MPI startup(): 49 745854 gmz17.benchmarkcenter.megware.com 49
[0] MPI startup(): 50 745753 gmz17.benchmarkcenter.megware.com 50
[0] MPI startup(): 51 745747 gmz17.benchmarkcenter.megware.com 51
[0] MPI startup(): 52 745813 gmz17.benchmarkcenter.megware.com 52
[0] MPI startup(): 53 745763 gmz17.benchmarkcenter.megware.com 53
[0] MPI startup(): 54 745790 gmz17.benchmarkcenter.megware.com 54
[0] MPI startup(): 55 745867 gmz17.benchmarkcenter.megware.com 55
[0] MPI startup(): 56 745820 gmz17.benchmarkcenter.megware.com 56
[0] MPI startup(): 57 745802 gmz17.benchmarkcenter.megware.com 57
[0] MPI startup(): 58 745805 gmz17.benchmarkcenter.megware.com 58
[0] MPI startup(): 59 745914 gmz17.benchmarkcenter.megware.com 59
[0] MPI startup(): 60 745825 gmz17.benchmarkcenter.megware.com 60
[0] MPI startup(): 61 745826 gmz17.benchmarkcenter.megware.com 61
[0] MPI startup(): 62 745806 gmz17.benchmarkcenter.megware.com 62
[0] MPI startup(): 63 745841 gmz17.benchmarkcenter.megware.com 63
[0] MPI startup(): 64 745871 gmz17.benchmarkcenter.megware.com 64
[0] MPI startup(): 65 745800 gmz17.benchmarkcenter.megware.com 65
[0] MPI startup(): 66 745840 gmz17.benchmarkcenter.megware.com 66
[0] MPI startup(): 67 745903 gmz17.benchmarkcenter.megware.com 67
[0] MPI startup(): 68 745930 gmz17.benchmarkcenter.megware.com 68
[0] MPI startup(): 69 745801 gmz17.benchmarkcenter.megware.com 69
[0] MPI startup(): 70 745804 gmz17.benchmarkcenter.megware.com 70
[0] MPI startup(): 71 745824 gmz17.benchmarkcenter.megware.com 71
[0] MPI startup(): 72 745822 gmz17.benchmarkcenter.megware.com 72
[0] MPI startup(): 73 745823 gmz17.benchmarkcenter.megware.com 73
[0] MPI startup(): 74 745807 gmz17.benchmarkcenter.megware.com 74
[0] MPI startup(): 75 745880 gmz17.benchmarkcenter.megware.com 75
[0] MPI startup(): 76 745810 gmz17.benchmarkcenter.megware.com 76
[0] MPI startup(): 77 745846 gmz17.benchmarkcenter.megware.com 77
[0] MPI startup(): 78 745843 gmz17.benchmarkcenter.megware.com 78
[0] MPI startup(): 79 745818 gmz17.benchmarkcenter.megware.com 79
[0] MPI startup(): 80 745913 gmz17.benchmarkcenter.megware.com 80
[0] MPI startup(): 81 745749 gmz17.benchmarkcenter.megware.com 81
[0] MPI startup(): 82 745798 gmz17.benchmarkcenter.megware.com 82
[0] MPI startup(): 83 745882 gmz17.benchmarkcenter.megware.com 83
[0] MPI startup(): 84 745883 gmz17.benchmarkcenter.megware.com 84
[0] MPI startup(): 85 745783 gmz17.benchmarkcenter.megware.com 85
[0] MPI startup(): 86 745885 gmz17.benchmarkcenter.megware.com 86
[0] MPI startup(): 87 745859 gmz17.benchmarkcenter.megware.com 87
[0] MPI startup(): 88 745821 gmz17.benchmarkcenter.megware.com 88
[0] MPI startup(): 89 745764 gmz17.benchmarkcenter.megware.com 89
[0] MPI startup(): 90 745760 gmz17.benchmarkcenter.megware.com 90
[0] MPI startup(): 91 745858 gmz17.benchmarkcenter.megware.com 91
[0] MPI startup(): 92 745844 gmz17.benchmarkcenter.megware.com 92
[0] MPI startup(): 93 745773 gmz17.benchmarkcenter.megware.com 93
[0] MPI startup(): 94 745757 gmz17.benchmarkcenter.megware.com 94
[0] MPI startup(): 95 745799 gmz17.benchmarkcenter.megware.com 95
[0] MPI startup(): 96 745819 gmz17.benchmarkcenter.megware.com 96
[0] MPI startup(): 97 745923 gmz17.benchmarkcenter.megware.com 97
[0] MPI startup(): 98 745811 gmz17.benchmarkcenter.megware.com 98
[0] MPI startup(): 99 745881 gmz17.benchmarkcenter.megware.com 99
[0] MPI startup(): 100 745766 gmz17.benchmarkcenter.megware.com 100
[0] MPI startup(): 101 745759 gmz17.benchmarkcenter.megware.com 101
[0] MPI startup(): 102 745916 gmz17.benchmarkcenter.megware.com 102
[0] MPI startup(): 103 745899 gmz17.benchmarkcenter.megware.com 103
[0] MPI startup(): 104 745767 gmz17.benchmarkcenter.megware.com 104
[0] MPI startup(): 105 745901 gmz17.benchmarkcenter.megware.com 105
[0] MPI startup(): 106 745857 gmz17.benchmarkcenter.megware.com 106
[0] MPI startup(): 107 745776 gmz17.benchmarkcenter.megware.com 107
[0] MPI startup(): 108 745900 gmz17.benchmarkcenter.megware.com 108
[0] MPI startup(): 109 745896 gmz17.benchmarkcenter.megware.com 109
[0] MPI startup(): 110 745873 gmz17.benchmarkcenter.megware.com 110
[0] MPI startup(): 111 745875 gmz17.benchmarkcenter.megware.com 111
[0] MPI startup(): 112 745779 gmz17.benchmarkcenter.megware.com 112
[0] MPI startup(): 113 745829 gmz17.benchmarkcenter.megware.com 113
[0] MPI startup(): 114 745921 gmz17.benchmarkcenter.megware.com 114
[0] MPI startup(): 115 745917 gmz17.benchmarkcenter.megware.com 115
[0] MPI startup(): 116 745931 gmz17.benchmarkcenter.megware.com 116
[0] MPI startup(): 117 745860 gmz17.benchmarkcenter.megware.com 117
[0] MPI startup(): 118 745836 gmz17.benchmarkcenter.megware.com 118
[0] MPI startup(): 119 745919 gmz17.benchmarkcenter.megware.com 119
[0] MPI startup(): 120 745920 gmz17.benchmarkcenter.megware.com 120
[0] MPI startup(): 121 745927 gmz17.benchmarkcenter.megware.com 121
[0] MPI startup(): 122 745815 gmz17.benchmarkcenter.megware.com 122
[0] MPI startup(): 123 745774 gmz17.benchmarkcenter.megware.com 123
[0] MPI startup(): 124 745928 gmz17.benchmarkcenter.megware.com 124
[0] MPI startup(): 125 745814 gmz17.benchmarkcenter.megware.com 125
[0] MPI startup(): 126 745816 gmz17.benchmarkcenter.megware.com 126
[0] MPI startup(): 127 745777 gmz17.benchmarkcenter.megware.com 127
[0] MPI startup(): 128 745924 gmz17.benchmarkcenter.megware.com 128
[0] MPI startup(): 129 745833 gmz17.benchmarkcenter.megware.com 129
[0] MPI startup(): 130 745922 gmz17.benchmarkcenter.megware.com 130
[0] MPI startup(): 131 745769 gmz17.benchmarkcenter.megware.com 131
[0] MPI startup(): 132 745904 gmz17.benchmarkcenter.megware.com 132
[0] MPI startup(): 133 745933 gmz17.benchmarkcenter.megware.com 133
[0] MPI startup(): 134 745897 gmz17.benchmarkcenter.megware.com 134
[0] MPI startup(): 135 745887 gmz17.benchmarkcenter.megware.com 135
[0] MPI startup(): 136 745768 gmz17.benchmarkcenter.megware.com 136
[0] MPI startup(): 137 745786 gmz17.benchmarkcenter.megware.com 137
[0] MPI startup(): 138 745863 gmz17.benchmarkcenter.megware.com 138
[0] MPI startup(): 139 745864 gmz17.benchmarkcenter.megware.com 139
[0] MPI startup(): 140 745755 gmz17.benchmarkcenter.megware.com 140
[0] MPI startup(): 141 745781 gmz17.benchmarkcenter.megware.com 141
[0] MPI startup(): 142 745888 gmz17.benchmarkcenter.megware.com 142
[0] MPI startup(): 143 745877 gmz17.benchmarkcenter.megware.com 143
[0] MPI startup(): 144 745771 gmz17.benchmarkcenter.megware.com 144
[0] MPI startup(): 145 745866 gmz17.benchmarkcenter.megware.com 145
[0] MPI startup(): 146 745870 gmz17.benchmarkcenter.megware.com 146
[0] MPI startup(): 147 745862 gmz17.benchmarkcenter.megware.com 147
[0] MPI startup(): 148 745874 gmz17.benchmarkcenter.megware.com 148
[0] MPI startup(): 149 745902 gmz17.benchmarkcenter.megware.com 149
[0] MPI startup(): 150 745894 gmz17.benchmarkcenter.megware.com 150
[0] MPI startup(): 151 745743 gmz17.benchmarkcenter.megware.com 151
[0] MPI startup(): 152 745817 gmz17.benchmarkcenter.megware.com 152
[0] MPI startup(): 153 745748 gmz17.benchmarkcenter.megware.com 153
[0] MPI startup(): 154 745850 gmz17.benchmarkcenter.megware.com 154
[0] MPI startup(): 155 745849 gmz17.benchmarkcenter.megware.com 155
[0] MPI startup(): 156 745837 gmz17.benchmarkcenter.megware.com 156
[0] MPI startup(): 157 745831 gmz17.benchmarkcenter.megware.com 157
[0] MPI startup(): 158 745778 gmz17.benchmarkcenter.megware.com 158
[0] MPI startup(): 159 745855 gmz17.benchmarkcenter.megware.com 159
[0] MPI startup(): 160 745892 gmz17.benchmarkcenter.megware.com 160
[0] MPI startup(): 161 745861 gmz17.benchmarkcenter.megware.com 161
[0] MPI startup(): 162 745893 gmz17.benchmarkcenter.megware.com 162
[0] MPI startup(): 163 745834 gmz17.benchmarkcenter.megware.com 163
[0] MPI startup(): 164 745756 gmz17.benchmarkcenter.megware.com 164
[0] MPI startup(): 165 745898 gmz17.benchmarkcenter.megware.com 165
[0] MPI startup(): 166 745891 gmz17.benchmarkcenter.megware.com 166
[0] MPI startup(): 167 745878 gmz17.benchmarkcenter.megware.com 167
[0] MPI startup(): 168 745787 gmz17.benchmarkcenter.megware.com 168
[0] MPI startup(): 169 745918 gmz17.benchmarkcenter.megware.com 169
[0] MPI startup(): 170 745772 gmz17.benchmarkcenter.megware.com 170
[0] MPI startup(): 171 745761 gmz17.benchmarkcenter.megware.com 171
[0] MPI startup(): 172 745856 gmz17.benchmarkcenter.megware.com 172
[0] MPI startup(): 173 745895 gmz17.benchmarkcenter.megware.com 173
[0] MPI startup(): 174 745926 gmz17.benchmarkcenter.megware.com 174
[0] MPI startup(): 175 745889 gmz17.benchmarkcenter.megware.com 175
[0] MPI startup(): 176 745828 gmz17.benchmarkcenter.megware.com 176
[0] MPI startup(): 177 745780 gmz17.benchmarkcenter.megware.com 177
[0] MPI startup(): 178 745812 gmz17.benchmarkcenter.megware.com 178
[0] MPI startup(): 179 745770 gmz17.benchmarkcenter.megware.com 179
[0] MPI startup(): 180 745752 gmz17.benchmarkcenter.megware.com 180
[0] MPI startup(): 181 745827 gmz17.benchmarkcenter.megware.com 181
[0] MPI startup(): 182 745906 gmz17.benchmarkcenter.megware.com 182
[0] MPI startup(): 183 745835 gmz17.benchmarkcenter.megware.com 183
[0] MPI startup(): 184 745765 gmz17.benchmarkcenter.megware.com 184
[0] MPI startup(): 185 745868 gmz17.benchmarkcenter.megware.com 185
[0] MPI startup(): 186 745915 gmz17.benchmarkcenter.megware.com 186
[0] MPI startup(): 187 745782 gmz17.benchmarkcenter.megware.com 187
[0] MPI startup(): 188 745925 gmz17.benchmarkcenter.megware.com 188
[0] MPI startup(): 189 745762 gmz17.benchmarkcenter.megware.com 189
[0] MPI startup(): 190 745775 gmz17.benchmarkcenter.megware.com 190
[0] MPI startup(): 191 745932 gmz17.benchmarkcenter.megware.com 191
OMP: pid 745854 tid 745854 thread 0 bound to OS proc set {49}
OMP: pid 745808 tid 745808 thread 0 bound to OS proc set {26}
OMP: pid 745838 tid 745838 thread 0 bound to OS proc set {33}
OMP: pid 745853 tid 745853 thread 0 bound to OS proc set {40}
OMP: pid 745862 tid 745862 thread 0 bound to OS proc set {147}
OMP: pid 745907 tid 745907 thread 0 bound to OS proc set {5}
OMP: pid 745878 tid 745878 thread 0 bound to OS proc set {167}
OMP: pid 745810 tid 745810 thread 0 bound to OS proc set {76}
OMP: pid 745852 tid 745852 thread 0 bound to OS proc set {28}
OMP: pid 745923 tid 745923 thread 0 bound to OS proc set {97}
OMP: pid 745832 tid 745832 thread 0 bound to OS proc set {46}
OMP: pid 745816 tid 745816 thread 0 bound to OS proc set {126}
OMP: pid 745757 tid 745757 thread 0 bound to OS proc set {94}
OMP: pid 745823 tid 745823 thread 0 bound to OS proc set {73}
OMP: pid 745802 tid 745802 thread 0 bound to OS proc set {57}
OMP: pid 745769 tid 745769 thread 0 bound to OS proc set {131}
OMP: pid 745771 tid 745771 thread 0 bound to OS proc set {144}
OMP: pid 745885 tid 745885 thread 0 bound to OS proc set {86}
OMP: pid 745846 tid 745846 thread 0 bound to OS proc set {77}
OMP: pid 745827 tid 745827 thread 0 bound to OS proc set {181}
OMP: pid 745780 tid 745780 thread 0 bound to OS proc set {177}
OMP: pid 745871 tid 745871 thread 0 bound to OS proc set {64}
OMP: pid 745908 tid 745908 thread 0 bound to OS proc set {44}
OMP: pid 745760 tid 745760 thread 0 bound to OS proc set {90}
OMP: pid 745890 tid 745890 thread 0 bound to OS proc set {43}
OMP: pid 745821 tid 745821 thread 0 bound to OS proc set {88}
OMP: pid 745887 tid 745887 thread 0 bound to OS proc set {135}
OMP: pid 745752 tid 745752 thread 0 bound to OS proc set {180}
OMP: pid 745826 tid 745826 thread 0 bound to OS proc set {61}
OMP: pid 745794 tid 745794 thread 0 bound to OS proc set {27}
OMP: pid 745841 tid 745841 thread 0 bound to OS proc set {63}
OMP: pid 745813 tid 745813 thread 0 bound to OS proc set {52}
OMP: pid 745845 tid 745845 thread 0 bound to OS proc set {0}
OMP: pid 745911 tid 745911 thread 0 bound to OS proc set {20}
OMP: pid 745913 tid 745913 thread 0 bound to OS proc set {80}
LAMMPS (22 Jul 2025)
OMP: pid 745788 tid 745788 thread 0 bound to OS proc set {2}
OMP: pid 745933 tid 745933 thread 0 bound to OS proc set {133}
OMP: pid 745791 tid 745791 thread 0 bound to OS proc set {39}
OMP: pid 745892 tid 745892 thread 0 bound to OS proc set {160}
OMP: pid 745831 tid 745831 thread 0 bound to OS proc set {157}
OMP: pid 745898 tid 745898 thread 0 bound to OS proc set {165}
OMP: pid 745779 tid 745779 thread 0 bound to OS proc set {112}
OMP: pid 745879 tid 745879 thread 0 bound to OS proc set {4}
OMP: pid 745758 tid 745758 thread 0 bound to OS proc set {19}
OMP: pid 745809 tid 745809 thread 0 bound to OS proc set {12}
OMP: pid 745806 tid 745806 thread 0 bound to OS proc set {62}
OMP: pid 745865 tid 745865 thread 0 bound to OS proc set {17}
OMP: pid 745915 tid 745915 thread 0 bound to OS proc set {186}
OMP: pid 745868 tid 745868 thread 0 bound to OS proc set {185}
OMP: pid 745929 tid 745929 thread 0 bound to OS proc set {38}
OMP: pid 745742 tid 745742 thread 0 bound to OS proc set {29}
OMP: pid 745877 tid 745877 thread 0 bound to OS proc set {143}
OMP: pid 745842 tid 745842 thread 0 bound to OS proc set {34}
OMP: pid 745891 tid 745891 thread 0 bound to OS proc set {166}
OMP: pid 745800 tid 745800 thread 0 bound to OS proc set {65}
OMP: pid 745866 tid 745866 thread 0 bound to OS proc set {145}
OMP: pid 745797 tid 745797 thread 0 bound to OS proc set {25}
OMP: pid 745921 tid 745921 thread 0 bound to OS proc set {114}
OMP: pid 745789 tid 745789 thread 0 bound to OS proc set {16}
OMP: pid 745858 tid 745858 thread 0 bound to OS proc set {91}
OMP: pid 745918 tid 745918 thread 0 bound to OS proc set {169}
OMP: pid 745749 tid 745749 thread 0 bound to OS proc set {81}
OMP: pid 745750 tid 745750 thread 0 bound to OS proc set {24}
OMP: pid 745796 tid 745796 thread 0 bound to OS proc set {6}
OMP: pid 745778 tid 745778 thread 0 bound to OS proc set {158}
OMP: pid 745848 tid 745848 thread 0 bound to OS proc set {21}
OMP: pid 745745 tid 745745 thread 0 bound to OS proc set {15}
OMP: pid 745785 tid 745785 thread 0 bound to OS proc set {1}
OMP: pid 745776 tid 745776 thread 0 bound to OS proc set {107}
OMP: pid 745884 tid 745884 thread 0 bound to OS proc set {42}
OMP: pid 745849 tid 745849 thread 0 bound to OS proc set {155}
OMP: pid 745895 tid 745895 thread 0 bound to OS proc set {173}
OMP: pid 745900 tid 745900 thread 0 bound to OS proc set {108}
OMP: pid 745855 tid 745855 thread 0 bound to OS proc set {159}
OMP: pid 745824 tid 745824 thread 0 bound to OS proc set {71}
OMP: pid 745805 tid 745805 thread 0 bound to OS proc set {58}
OMP: pid 745886 tid 745886 thread 0 bound to OS proc set {35}
OMP: pid 745896 tid 745896 thread 0 bound to OS proc set {109}
OMP: pid 745874 tid 745874 thread 0 bound to OS proc set {148}
OMP: pid 745872 tid 745872 thread 0 bound to OS proc set {8}
OMP: pid 745818 tid 745818 thread 0 bound to OS proc set {79}
OMP: pid 745784 tid 745784 thread 0 bound to OS proc set {13}
OMP: pid 745922 tid 745922 thread 0 bound to OS proc set {130}
OMP: pid 745762 tid 745762 thread 0 bound to OS proc set {189}
OMP: pid 745875 tid 745875 thread 0 bound to OS proc set {111}
OMP: pid 745851 tid 745851 thread 0 bound to OS proc set {36}
OMP: pid 745817 tid 745817 thread 0 bound to OS proc set {152}
OMP: pid 745912 tid 745912 thread 0 bound to OS proc set {14}
OMP: pid 745767 tid 745767 thread 0 bound to OS proc set {104}
OMP: pid 745914 tid 745914 thread 0 bound to OS proc set {59}
OMP: pid 745882 tid 745882 thread 0 bound to OS proc set {83}
OMP: pid 745839 tid 745839 thread 0 bound to OS proc set {47}
OMP: pid 745856 tid 745856 thread 0 bound to OS proc set {172}
OMP: pid 745861 tid 745861 thread 0 bound to OS proc set {161}
OMP: pid 745843 tid 745843 thread 0 bound to OS proc set {78}
OMP: pid 745790 tid 745790 thread 0 bound to OS proc set {54}
OMP: pid 745927 tid 745927 thread 0 bound to OS proc set {121}
OMP: pid 745897 tid 745897 thread 0 bound to OS proc set {134}
OMP: pid 745888 tid 745888 thread 0 bound to OS proc set {142}
OMP: pid 745820 tid 745820 thread 0 bound to OS proc set {56}
OMP: pid 745819 tid 745819 thread 0 bound to OS proc set {96}
OMP: pid 745931 tid 745931 thread 0 bound to OS proc set {116}
OMP: pid 745902 tid 745902 thread 0 bound to OS proc set {149}
OMP: pid 745764 tid 745764 thread 0 bound to OS proc set {89}
OMP: pid 745889 tid 745889 thread 0 bound to OS proc set {175}
OMP: pid 745883 tid 745883 thread 0 bound to OS proc set {84}
OMP: pid 745840 tid 745840 thread 0 bound to OS proc set {66}
OMP: pid 745919 tid 745919 thread 0 bound to OS proc set {119}
OMP: pid 745864 tid 745864 thread 0 bound to OS proc set {139}
OMP: pid 745917 tid 745917 thread 0 bound to OS proc set {115}
OMP: pid 745812 tid 745812 thread 0 bound to OS proc set {178}
OMP: pid 745909 tid 745909 thread 0 bound to OS proc set {23}
OMP: pid 745759 tid 745759 thread 0 bound to OS proc set {101}
OMP: pid 745754 tid 745754 thread 0 bound to OS proc set {7}
OMP: pid 745910 tid 745910 thread 0 bound to OS proc set {3}
OMP: pid 745773 tid 745773 thread 0 bound to OS proc set {93}
OMP: pid 745744 tid 745744 thread 0 bound to OS proc set {10}
OMP: pid 745926 tid 745926 thread 0 bound to OS proc set {174}
OMP: pid 745770 tid 745770 thread 0 bound to OS proc set {179}
OMP: pid 745881 tid 745881 thread 0 bound to OS proc set {99}
OMP: pid 745899 tid 745899 thread 0 bound to OS proc set {103}
OMP: pid 745835 tid 745835 thread 0 bound to OS proc set {183}
OMP: pid 745870 tid 745870 thread 0 bound to OS proc set {146}
OMP: pid 745876 tid 745876 thread 0 bound to OS proc set {11}
OMP: pid 745904 tid 745904 thread 0 bound to OS proc set {132}
OMP: pid 745859 tid 745859 thread 0 bound to OS proc set {87}
OMP: pid 745830 tid 745830 thread 0 bound to OS proc set {31}
OMP: pid 745755 tid 745755 thread 0 bound to OS proc set {140}
OMP: pid 745766 tid 745766 thread 0 bound to OS proc set {100}
OMP: pid 745747 tid 745747 thread 0 bound to OS proc set {51}
OMP: pid 745801 tid 745801 thread 0 bound to OS proc set {69}
OMP: pid 745803 tid 745803 thread 0 bound to OS proc set {22}
OMP: pid 745781 tid 745781 thread 0 bound to OS proc set {141}
OMP: pid 745834 tid 745834 thread 0 bound to OS proc set {163}
OMP: pid 745795 tid 745795 thread 0 bound to OS proc set {18}
OMP: pid 745860 tid 745860 thread 0 bound to OS proc set {117}
OMP: pid 745804 tid 745804 thread 0 bound to OS proc set {70}
OMP: pid 745793 tid 745793 thread 0 bound to OS proc set {9}
OMP: pid 745815 tid 745815 thread 0 bound to OS proc set {122}
OMP: pid 745746 tid 745746 thread 0 bound to OS proc set {37}
OMP: pid 745925 tid 745925 thread 0 bound to OS proc set {188}
OMP: pid 745905 tid 745905 thread 0 bound to OS proc set {48}
OMP: pid 745829 tid 745829 thread 0 bound to OS proc set {113}
OMP: pid 745772 tid 745772 thread 0 bound to OS proc set {170}
OMP: pid 745828 tid 745828 thread 0 bound to OS proc set {176}
OMP: pid 745836 tid 745836 thread 0 bound to OS proc set {118}
OMP: pid 745916 tid 745916 thread 0 bound to OS proc set {102}
OMP: pid 745743 tid 745743 thread 0 bound to OS proc set {151}
OMP: pid 745869 tid 745869 thread 0 bound to OS proc set {41}
OMP: pid 745920 tid 745920 thread 0 bound to OS proc set {120}
OMP: pid 745783 tid 745783 thread 0 bound to OS proc set {85}
OMP: pid 745775 tid 745775 thread 0 bound to OS proc set {190}
OMP: pid 745873 tid 745873 thread 0 bound to OS proc set {110}
OMP: pid 745753 tid 745753 thread 0 bound to OS proc set {50}
OMP: pid 745807 tid 745807 thread 0 bound to OS proc set {74}
OMP: pid 745782 tid 745782 thread 0 bound to OS proc set {187}
OMP: pid 745763 tid 745763 thread 0 bound to OS proc set {53}
OMP: pid 745893 tid 745893 thread 0 bound to OS proc set {162}
OMP: pid 745932 tid 745932 thread 0 bound to OS proc set {191}
OMP: pid 745844 tid 745844 thread 0 bound to OS proc set {92}
OMP: pid 745894 tid 745894 thread 0 bound to OS proc set {150}
OMP: pid 745786 tid 745786 thread 0 bound to OS proc set {137}
OMP: pid 745799 tid 745799 thread 0 bound to OS proc set {95}
OMP: pid 745930 tid 745930 thread 0 bound to OS proc set {68}
OMP: pid 745906 tid 745906 thread 0 bound to OS proc set {182}
OMP: pid 745867 tid 745867 thread 0 bound to OS proc set {55}
OMP: pid 745850 tid 745850 thread 0 bound to OS proc set {154}
OMP: pid 745811 tid 745811 thread 0 bound to OS proc set {98}
OMP: pid 745756 tid 745756 thread 0 bound to OS proc set {164}
OMP: pid 745748 tid 745748 thread 0 bound to OS proc set {153}
OMP: pid 745792 tid 745792 thread 0 bound to OS proc set {32}
OMP: pid 745825 tid 745825 thread 0 bound to OS proc set {60}
OMP: pid 745798 tid 745798 thread 0 bound to OS proc set {82}
OMP: pid 745751 tid 745751 thread 0 bound to OS proc set {30}
OMP: pid 745903 tid 745903 thread 0 bound to OS proc set {67}
OMP: pid 745901 tid 745901 thread 0 bound to OS proc set {105}
OMP: pid 745837 tid 745837 thread 0 bound to OS proc set {156}
OMP: pid 745814 tid 745814 thread 0 bound to OS proc set {125}
OMP: pid 745765 tid 745765 thread 0 bound to OS proc set {184}
OMP: pid 745924 tid 745924 thread 0 bound to OS proc set {128}
OMP: pid 745768 tid 745768 thread 0 bound to OS proc set {136}
OMP: pid 745847 tid 745847 thread 0 bound to OS proc set {45}
OMP: pid 745863 tid 745863 thread 0 bound to OS proc set {138}
OMP: pid 745774 tid 745774 thread 0 bound to OS proc set {123}
OMP: pid 745928 tid 745928 thread 0 bound to OS proc set {124}
OMP: pid 745787 tid 745787 thread 0 bound to OS proc set {168}
OMP: pid 745761 tid 745761 thread 0 bound to OS proc set {171}
OMP: pid 745777 tid 745777 thread 0 bound to OS proc set {127}
OMP: pid 745833 tid 745833 thread 0 bound to OS proc set {129}
OMP: pid 745880 tid 745880 thread 0 bound to OS proc set {75}
OMP: pid 745822 tid 745822 thread 0 bound to OS proc set {72}
OMP: pid 745857 tid 745857 thread 0 bound to OS proc set {106}
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 = 0.015 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 1.15979 on 192 procs for 10 steps with 32768000 atoms
Performance: 3.725 ns/day, 6.443 hours/ns, 8.622 timesteps/s, 282.533 Matom-step/s
99.0% CPU use with 192 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.88923 | 0.91285 | 0.94428 | 1.2 | 78.71
Neigh | 0.039072 | 0.044046 | 0.045876 | 0.5 | 3.80
Comm | 0.073148 | 0.096232 | 0.12996 | 4.2 | 8.30
Output | 0.001561 | 0.0029009 | 0.0073591 | 2.3 | 0.25
Modify | 0.054706 | 0.072483 | 0.084815 | 2.6 | 6.25
Other | | 0.03128 | | | 2.70
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 79.4145 on 192 procs for 500 steps with 32768000 atoms
Performance: 2.720 ns/day, 8.824 hours/ns, 6.296 timesteps/s, 206.310 Matom-step/s
99.0% CPU use with 192 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 64.397 | 64.932 | 65.68 | 3.4 | 81.76
Neigh | 3.6812 | 3.8137 | 3.9405 | 2.9 | 4.80
Comm | 4.6628 | 5.5663 | 6.7623 | 19.1 | 7.01
Output | 0.017459 | 0.027412 | 0.052411 | 4.6 | 0.03
Modify | 2.2644 | 3.7072 | 4.1884 | 16.5 | 4.67
Other | | 1.368 | | | 1.72
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
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/defaults/orig/oneview_results_1758134837/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_ZEN5/175-813-3649/intel/LAMMPS/run/oneview_runs/defaults/orig/oneview_results_1758134837/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/defaults/orig/oneview_results_1758134837/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/defaults/orig/oneview_results_1758134837/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/defaults/orig/oneview_results_1758134837/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/defaults/orig/oneview_results_1758134837/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/defaults/orig/oneview_results_1758134837/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/defaults/orig/oneview_results_1758134837/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/defaults/orig/oneview_results_1758134837/tools/lprof_npsu_run_0 #
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