options

Executable Output


* [MAQAO] Info: Detected 256 Lprof instances in isix03.benchmarkcenter.megware.com. 
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.14  Build 20240911 (id: b3fc682)
[0] MPI startup(): Copyright (C) 2003-2024 Intel Corporation.  All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.0.0/mpi/2021.14/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank    Pid      Node name                           Pin cpu
[0] MPI startup(): 0       186083   isix03.benchmarkcenter.megware.com  {0}
[0] MPI startup(): 1       186071   isix03.benchmarkcenter.megware.com  {1}
[0] MPI startup(): 2       186040   isix03.benchmarkcenter.megware.com  {2}
[0] MPI startup(): 3       186043   isix03.benchmarkcenter.megware.com  {3}
[0] MPI startup(): 4       186076   isix03.benchmarkcenter.megware.com  {4}
[0] MPI startup(): 5       186077   isix03.benchmarkcenter.megware.com  {5}
[0] MPI startup(): 6       186184   isix03.benchmarkcenter.megware.com  {6}
[0] MPI startup(): 7       186042   isix03.benchmarkcenter.megware.com  {7}
[0] MPI startup(): 8       186264   isix03.benchmarkcenter.megware.com  {8}
[0] MPI startup(): 9       186072   isix03.benchmarkcenter.megware.com  {9}
[0] MPI startup(): 10      186056   isix03.benchmarkcenter.megware.com  {10}
[0] MPI startup(): 11      186148   isix03.benchmarkcenter.megware.com  {11}
[0] MPI startup(): 12      186112   isix03.benchmarkcenter.megware.com  {12}
[0] MPI startup(): 13      186129   isix03.benchmarkcenter.megware.com  {13}
[0] MPI startup(): 14      186113   isix03.benchmarkcenter.megware.com  {14}
[0] MPI startup(): 15      186041   isix03.benchmarkcenter.megware.com  {15}
[0] MPI startup(): 16      186135   isix03.benchmarkcenter.megware.com  {16}
[0] MPI startup(): 17      186070   isix03.benchmarkcenter.megware.com  {17}
[0] MPI startup(): 18      186085   isix03.benchmarkcenter.megware.com  {18}
[0] MPI startup(): 19      186084   isix03.benchmarkcenter.megware.com  {19}
[0] MPI startup(): 20      186279   isix03.benchmarkcenter.megware.com  {20}
[0] MPI startup(): 21      186044   isix03.benchmarkcenter.megware.com  {21}
[0] MPI startup(): 22      186096   isix03.benchmarkcenter.megware.com  {22}
[0] MPI startup(): 23      186075   isix03.benchmarkcenter.megware.com  {23}
[0] MPI startup(): 24      186271   isix03.benchmarkcenter.megware.com  {24}
[0] MPI startup(): 25      186183   isix03.benchmarkcenter.megware.com  {25}
[0] MPI startup(): 26      186089   isix03.benchmarkcenter.megware.com  {26}
[0] MPI startup(): 27      186199   isix03.benchmarkcenter.megware.com  {27}
[0] MPI startup(): 28      186073   isix03.benchmarkcenter.megware.com  {28}
[0] MPI startup(): 29      186074   isix03.benchmarkcenter.megware.com  {29}
[0] MPI startup(): 30      186125   isix03.benchmarkcenter.megware.com  {30}
[0] MPI startup(): 31      186069   isix03.benchmarkcenter.megware.com  {31}
[0] MPI startup(): 32      186130   isix03.benchmarkcenter.megware.com  {32}
[0] MPI startup(): 33      186093   isix03.benchmarkcenter.megware.com  {33}
[0] MPI startup(): 34      186236   isix03.benchmarkcenter.megware.com  {34}
[0] MPI startup(): 35      186238   isix03.benchmarkcenter.megware.com  {35}
[0] MPI startup(): 36      186087   isix03.benchmarkcenter.megware.com  {36}
[0] MPI startup(): 37      186058   isix03.benchmarkcenter.megware.com  {37}
[0] MPI startup(): 38      186088   isix03.benchmarkcenter.megware.com  {38}
[0] MPI startup(): 39      186258   isix03.benchmarkcenter.megware.com  {39}
[0] MPI startup(): 40      186278   isix03.benchmarkcenter.megware.com  {40}
[0] MPI startup(): 41      186247   isix03.benchmarkcenter.megware.com  {41}
[0] MPI startup(): 42      186260   isix03.benchmarkcenter.megware.com  {42}
[0] MPI startup(): 43      186257   isix03.benchmarkcenter.megware.com  {43}
[0] MPI startup(): 44      186206   isix03.benchmarkcenter.megware.com  {44}
[0] MPI startup(): 45      186280   isix03.benchmarkcenter.megware.com  {45}
[0] MPI startup(): 46      186268   isix03.benchmarkcenter.megware.com  {46}
[0] MPI startup(): 47      186116   isix03.benchmarkcenter.megware.com  {47}
[0] MPI startup(): 48      186122   isix03.benchmarkcenter.megware.com  {48}
[0] MPI startup(): 49      186171   isix03.benchmarkcenter.megware.com  {49}
[0] MPI startup(): 50      186252   isix03.benchmarkcenter.megware.com  {50}
[0] MPI startup(): 51      186095   isix03.benchmarkcenter.megware.com  {51}
[0] MPI startup(): 52      186050   isix03.benchmarkcenter.megware.com  {52}
[0] MPI startup(): 53      186223   isix03.benchmarkcenter.megware.com  {53}
[0] MPI startup(): 54      186160   isix03.benchmarkcenter.megware.com  {54}
[0] MPI startup(): 55      186139   isix03.benchmarkcenter.megware.com  {55}
[0] MPI startup(): 56      186136   isix03.benchmarkcenter.megware.com  {56}
[0] MPI startup(): 57      186244   isix03.benchmarkcenter.megware.com  {57}
[0] MPI startup(): 58      186173   isix03.benchmarkcenter.megware.com  {58}
[0] MPI startup(): 59      186163   isix03.benchmarkcenter.megware.com  {59}
[0] MPI startup(): 60      186276   isix03.benchmarkcenter.megware.com  {60}
[0] MPI startup(): 61      186187   isix03.benchmarkcenter.megware.com  {61}
[0] MPI startup(): 62      186197   isix03.benchmarkcenter.megware.com  {62}
[0] MPI startup(): 63      186239   isix03.benchmarkcenter.megware.com  {63}
[0] MPI startup(): 64      186049   isix03.benchmarkcenter.megware.com  {64}
[0] MPI startup(): 65      186121   isix03.benchmarkcenter.megware.com  {65}
[0] MPI startup(): 66      186291   isix03.benchmarkcenter.megware.com  {66}
[0] MPI startup(): 67      186221   isix03.benchmarkcenter.megware.com  {67}
[0] MPI startup(): 68      186275   isix03.benchmarkcenter.megware.com  {68}
[0] MPI startup(): 69      186053   isix03.benchmarkcenter.megware.com  {69}
[0] MPI startup(): 70      186248   isix03.benchmarkcenter.megware.com  {70}
[0] MPI startup(): 71      186281   isix03.benchmarkcenter.megware.com  {71}
[0] MPI startup(): 72      186292   isix03.benchmarkcenter.megware.com  {72}
[0] MPI startup(): 73      186091   isix03.benchmarkcenter.megware.com  {73}
[0] MPI startup(): 74      186147   isix03.benchmarkcenter.megware.com  {74}
[0] MPI startup(): 75      186080   isix03.benchmarkcenter.megware.com  {75}
[0] MPI startup(): 76      186166   isix03.benchmarkcenter.megware.com  {76}
[0] MPI startup(): 77      186151   isix03.benchmarkcenter.megware.com  {77}
[0] MPI startup(): 78      186150   isix03.benchmarkcenter.megware.com  {78}
[0] MPI startup(): 79      186114   isix03.benchmarkcenter.megware.com  {79}
[0] MPI startup(): 80      186246   isix03.benchmarkcenter.megware.com  {80}
[0] MPI startup(): 81      186123   isix03.benchmarkcenter.megware.com  {81}
[0] MPI startup(): 82      186127   isix03.benchmarkcenter.megware.com  {82}
[0] MPI startup(): 83      186262   isix03.benchmarkcenter.megware.com  {83}
[0] MPI startup(): 84      186277   isix03.benchmarkcenter.megware.com  {84}
[0] MPI startup(): 85      186052   isix03.benchmarkcenter.megware.com  {85}
[0] MPI startup(): 86      186107   isix03.benchmarkcenter.megware.com  {86}
[0] MPI startup(): 87      186086   isix03.benchmarkcenter.megware.com  {87}
[0] MPI startup(): 88      186232   isix03.benchmarkcenter.megware.com  {88}
[0] MPI startup(): 89      186155   isix03.benchmarkcenter.megware.com  {89}
[0] MPI startup(): 90      186090   isix03.benchmarkcenter.megware.com  {90}
[0] MPI startup(): 91      186120   isix03.benchmarkcenter.megware.com  {91}
[0] MPI startup(): 92      186235   isix03.benchmarkcenter.megware.com  {92}
[0] MPI startup(): 93      186055   isix03.benchmarkcenter.megware.com  {93}
[0] MPI startup(): 94      186158   isix03.benchmarkcenter.megware.com  {94}
[0] MPI startup(): 95      186172   isix03.benchmarkcenter.megware.com  {95}
[0] MPI startup(): 96      186106   isix03.benchmarkcenter.megware.com  {96}
[0] MPI startup(): 97      186169   isix03.benchmarkcenter.megware.com  {97}
[0] MPI startup(): 98      186118   isix03.benchmarkcenter.megware.com  {98}
[0] MPI startup(): 99      186175   isix03.benchmarkcenter.megware.com  {99}
[0] MPI startup(): 100     186180   isix03.benchmarkcenter.megware.com  {100}
[0] MPI startup(): 101     186126   isix03.benchmarkcenter.megware.com  {101}
[0] MPI startup(): 102     186225   isix03.benchmarkcenter.megware.com  {102}
[0] MPI startup(): 103     186233   isix03.benchmarkcenter.megware.com  {103}
[0] MPI startup(): 104     186242   isix03.benchmarkcenter.megware.com  {104}
[0] MPI startup(): 105     186189   isix03.benchmarkcenter.megware.com  {105}
[0] MPI startup(): 106     186154   isix03.benchmarkcenter.megware.com  {106}
[0] MPI startup(): 107     186168   isix03.benchmarkcenter.megware.com  {107}
[0] MPI startup(): 108     186282   isix03.benchmarkcenter.megware.com  {108}
[0] MPI startup(): 109     186054   isix03.benchmarkcenter.megware.com  {109}
[0] MPI startup(): 110     186231   isix03.benchmarkcenter.megware.com  {110}
[0] MPI startup(): 111     186097   isix03.benchmarkcenter.megware.com  {111}
[0] MPI startup(): 112     186288   isix03.benchmarkcenter.megware.com  {112}
[0] MPI startup(): 113     186293   isix03.benchmarkcenter.megware.com  {113}
[0] MPI startup(): 114     186137   isix03.benchmarkcenter.megware.com  {114}
[0] MPI startup(): 115     186146   isix03.benchmarkcenter.megware.com  {115}
[0] MPI startup(): 116     186237   isix03.benchmarkcenter.megware.com  {116}
[0] MPI startup(): 117     186062   isix03.benchmarkcenter.megware.com  {117}
[0] MPI startup(): 118     186057   isix03.benchmarkcenter.megware.com  {118}
[0] MPI startup(): 119     186272   isix03.benchmarkcenter.megware.com  {119}
[0] MPI startup(): 120     186161   isix03.benchmarkcenter.megware.com  {120}
[0] MPI startup(): 121     186156   isix03.benchmarkcenter.megware.com  {121}
[0] MPI startup(): 122     186157   isix03.benchmarkcenter.megware.com  {122}
[0] MPI startup(): 123     186190   isix03.benchmarkcenter.megware.com  {123}
[0] MPI startup(): 124     186082   isix03.benchmarkcenter.megware.com  {124}
[0] MPI startup(): 125     186143   isix03.benchmarkcenter.megware.com  {125}
[0] MPI startup(): 126     186270   isix03.benchmarkcenter.megware.com  {126}
[0] MPI startup(): 127     186230   isix03.benchmarkcenter.megware.com  {127}
[0] MPI startup(): 128     186131   isix03.benchmarkcenter.megware.com  {128}
[0] MPI startup(): 129     186219   isix03.benchmarkcenter.megware.com  {129}
[0] MPI startup(): 130     186117   isix03.benchmarkcenter.megware.com  {130}
[0] MPI startup(): 131     186159   isix03.benchmarkcenter.megware.com  {131}
[0] MPI startup(): 132     186067   isix03.benchmarkcenter.megware.com  {132}
[0] MPI startup(): 133     186202   isix03.benchmarkcenter.megware.com  {133}
[0] MPI startup(): 134     186132   isix03.benchmarkcenter.megware.com  {134}
[0] MPI startup(): 135     186250   isix03.benchmarkcenter.megware.com  {135}
[0] MPI startup(): 136     186094   isix03.benchmarkcenter.megware.com  {136}
[0] MPI startup(): 137     186265   isix03.benchmarkcenter.megware.com  {137}
[0] MPI startup(): 138     186101   isix03.benchmarkcenter.megware.com  {138}
[0] MPI startup(): 139     186066   isix03.benchmarkcenter.megware.com  {139}
[0] MPI startup(): 140     186102   isix03.benchmarkcenter.megware.com  {140}
[0] MPI startup(): 141     186200   isix03.benchmarkcenter.megware.com  {141}
[0] MPI startup(): 142     186284   isix03.benchmarkcenter.megware.com  {142}
[0] MPI startup(): 143     186254   isix03.benchmarkcenter.megware.com  {143}
[0] MPI startup(): 144     186245   isix03.benchmarkcenter.megware.com  {144}
[0] MPI startup(): 145     186176   isix03.benchmarkcenter.megware.com  {145}
[0] MPI startup(): 146     186140   isix03.benchmarkcenter.megware.com  {146}
[0] MPI startup(): 147     186081   isix03.benchmarkcenter.megware.com  {147}
[0] MPI startup(): 148     186047   isix03.benchmarkcenter.megware.com  {148}
[0] MPI startup(): 149     186167   isix03.benchmarkcenter.megware.com  {149}
[0] MPI startup(): 150     186100   isix03.benchmarkcenter.megware.com  {150}
[0] MPI startup(): 151     186273   isix03.benchmarkcenter.megware.com  {151}
[0] MPI startup(): 152     186295   isix03.benchmarkcenter.megware.com  {152}
[0] MPI startup(): 153     186229   isix03.benchmarkcenter.megware.com  {153}
[0] MPI startup(): 154     186109   isix03.benchmarkcenter.megware.com  {154}
[0] MPI startup(): 155     186108   isix03.benchmarkcenter.megware.com  {155}
[0] MPI startup(): 156     186267   isix03.benchmarkcenter.megware.com  {156}
[0] MPI startup(): 157     186119   isix03.benchmarkcenter.megware.com  {157}
[0] MPI startup(): 158     186115   isix03.benchmarkcenter.megware.com  {158}
[0] MPI startup(): 159     186222   isix03.benchmarkcenter.megware.com  {159}
[0] MPI startup(): 160     186224   isix03.benchmarkcenter.megware.com  {160}
[0] MPI startup(): 161     186103   isix03.benchmarkcenter.megware.com  {161}
[0] MPI startup(): 162     186063   isix03.benchmarkcenter.megware.com  {162}
[0] MPI startup(): 163     186186   isix03.benchmarkcenter.megware.com  {163}
[0] MPI startup(): 164     186104   isix03.benchmarkcenter.megware.com  {164}
[0] MPI startup(): 165     186045   isix03.benchmarkcenter.megware.com  {165}
[0] MPI startup(): 166     186138   isix03.benchmarkcenter.megware.com  {166}
[0] MPI startup(): 167     186249   isix03.benchmarkcenter.megware.com  {167}
[0] MPI startup(): 168     186064   isix03.benchmarkcenter.megware.com  {168}
[0] MPI startup(): 169     186065   isix03.benchmarkcenter.megware.com  {169}
[0] MPI startup(): 170     186098   isix03.benchmarkcenter.megware.com  {170}
[0] MPI startup(): 171     186283   isix03.benchmarkcenter.megware.com  {171}
[0] MPI startup(): 172     186182   isix03.benchmarkcenter.megware.com  {172}
[0] MPI startup(): 173     186068   isix03.benchmarkcenter.megware.com  {173}
[0] MPI startup(): 174     186099   isix03.benchmarkcenter.megware.com  {174}
[0] MPI startup(): 175     186193   isix03.benchmarkcenter.megware.com  {175}
[0] MPI startup(): 176     186253   isix03.benchmarkcenter.megware.com  {176}
[0] MPI startup(): 177     186269   isix03.benchmarkcenter.megware.com  {177}
[0] MPI startup(): 178     186210   isix03.benchmarkcenter.megware.com  {178}
[0] MPI startup(): 179     186209   isix03.benchmarkcenter.megware.com  {179}
[0] MPI startup(): 180     186251   isix03.benchmarkcenter.megware.com  {180}
[0] MPI startup(): 181     186051   isix03.benchmarkcenter.megware.com  {181}
[0] MPI startup(): 182     186243   isix03.benchmarkcenter.megware.com  {182}
[0] MPI startup(): 183     186294   isix03.benchmarkcenter.megware.com  {183}
[0] MPI startup(): 184     186195   isix03.benchmarkcenter.megware.com  {184}
[0] MPI startup(): 185     186179   isix03.benchmarkcenter.megware.com  {185}
[0] MPI startup(): 186     186296   isix03.benchmarkcenter.megware.com  {186}
[0] MPI startup(): 187     186177   isix03.benchmarkcenter.megware.com  {187}
[0] MPI startup(): 188     186144   isix03.benchmarkcenter.megware.com  {188}
[0] MPI startup(): 189     186234   isix03.benchmarkcenter.megware.com  {189}
[0] MPI startup(): 190     186192   isix03.benchmarkcenter.megware.com  {190}
[0] MPI startup(): 191     186201   isix03.benchmarkcenter.megware.com  {191}
[0] MPI startup(): 192     186079   isix03.benchmarkcenter.megware.com  {192}
[0] MPI startup(): 193     186046   isix03.benchmarkcenter.megware.com  {193}
[0] MPI startup(): 194     186164   isix03.benchmarkcenter.megware.com  {194}
[0] MPI startup(): 195     186240   isix03.benchmarkcenter.megware.com  {195}
[0] MPI startup(): 196     186287   isix03.benchmarkcenter.megware.com  {196}
[0] MPI startup(): 197     186059   isix03.benchmarkcenter.megware.com  {197}
[0] MPI startup(): 198     186263   isix03.benchmarkcenter.megware.com  {198}
[0] MPI startup(): 199     186191   isix03.benchmarkcenter.megware.com  {199}
[0] MPI startup(): 200     186149   isix03.benchmarkcenter.megware.com  {200}
[0] MPI startup(): 201     186286   isix03.benchmarkcenter.megware.com  {201}
[0] MPI startup(): 202     186165   isix03.benchmarkcenter.megware.com  {202}
[0] MPI startup(): 203     186142   isix03.benchmarkcenter.megware.com  {203}
[0] MPI startup(): 204     186198   isix03.benchmarkcenter.megware.com  {204}
[0] MPI startup(): 205     186181   isix03.benchmarkcenter.megware.com  {205}
[0] MPI startup(): 206     186152   isix03.benchmarkcenter.megware.com  {206}
[0] MPI startup(): 207     186204   isix03.benchmarkcenter.megware.com  {207}
[0] MPI startup(): 208     186227   isix03.benchmarkcenter.megware.com  {208}
[0] MPI startup(): 209     186297   isix03.benchmarkcenter.megware.com  {209}
[0] MPI startup(): 210     186241   isix03.benchmarkcenter.megware.com  {210}
[0] MPI startup(): 211     186048   isix03.benchmarkcenter.megware.com  {211}
[0] MPI startup(): 212     186134   isix03.benchmarkcenter.megware.com  {212}
[0] MPI startup(): 213     186256   isix03.benchmarkcenter.megware.com  {213}
[0] MPI startup(): 214     186266   isix03.benchmarkcenter.megware.com  {214}
[0] MPI startup(): 215     186133   isix03.benchmarkcenter.megware.com  {215}
[0] MPI startup(): 216     186061   isix03.benchmarkcenter.megware.com  {216}
[0] MPI startup(): 217     186274   isix03.benchmarkcenter.megware.com  {217}
[0] MPI startup(): 218     186211   isix03.benchmarkcenter.megware.com  {218}
[0] MPI startup(): 219     186226   isix03.benchmarkcenter.megware.com  {219}
[0] MPI startup(): 220     186259   isix03.benchmarkcenter.megware.com  {220}
[0] MPI startup(): 221     186153   isix03.benchmarkcenter.megware.com  {221}
[0] MPI startup(): 222     186162   isix03.benchmarkcenter.megware.com  {222}
[0] MPI startup(): 223     186078   isix03.benchmarkcenter.megware.com  {223}
[0] MPI startup(): 224     186178   isix03.benchmarkcenter.megware.com  {224}
[0] MPI startup(): 225     186214   isix03.benchmarkcenter.megware.com  {225}
[0] MPI startup(): 226     186228   isix03.benchmarkcenter.megware.com  {226}
[0] MPI startup(): 227     186128   isix03.benchmarkcenter.megware.com  {227}
[0] MPI startup(): 228     186215   isix03.benchmarkcenter.megware.com  {228}
[0] MPI startup(): 229     186220   isix03.benchmarkcenter.megware.com  {229}
[0] MPI startup(): 230     186261   isix03.benchmarkcenter.megware.com  {230}
[0] MPI startup(): 231     186213   isix03.benchmarkcenter.megware.com  {231}
[0] MPI startup(): 232     186205   isix03.benchmarkcenter.megware.com  {232}
[0] MPI startup(): 233     186188   isix03.benchmarkcenter.megware.com  {233}
[0] MPI startup(): 234     186212   isix03.benchmarkcenter.megware.com  {234}
[0] MPI startup(): 235     186290   isix03.benchmarkcenter.megware.com  {235}
[0] MPI startup(): 236     186208   isix03.benchmarkcenter.megware.com  {236}
[0] MPI startup(): 237     186207   isix03.benchmarkcenter.megware.com  {237}
[0] MPI startup(): 238     186285   isix03.benchmarkcenter.megware.com  {238}
[0] MPI startup(): 239     186060   isix03.benchmarkcenter.megware.com  {239}
[0] MPI startup(): 240     186289   isix03.benchmarkcenter.megware.com  {240}
[0] MPI startup(): 241     186217   isix03.benchmarkcenter.megware.com  {241}
[0] MPI startup(): 242     186196   isix03.benchmarkcenter.megware.com  {242}
[0] MPI startup(): 243     186110   isix03.benchmarkcenter.megware.com  {243}
[0] MPI startup(): 244     186145   isix03.benchmarkcenter.megware.com  {244}
[0] MPI startup(): 245     186194   isix03.benchmarkcenter.megware.com  {245}
[0] MPI startup(): 246     186218   isix03.benchmarkcenter.megware.com  {246}
[0] MPI startup(): 247     186255   isix03.benchmarkcenter.megware.com  {247}
[0] MPI startup(): 248     186170   isix03.benchmarkcenter.megware.com  {248}
[0] MPI startup(): 249     186203   isix03.benchmarkcenter.megware.com  {249}
[0] MPI startup(): 250     186092   isix03.benchmarkcenter.megware.com  {250}
[0] MPI startup(): 251     186185   isix03.benchmarkcenter.megware.com  {251}
[0] MPI startup(): 252     186174   isix03.benchmarkcenter.megware.com  {252}
[0] MPI startup(): 253     186105   isix03.benchmarkcenter.megware.com  {253}
[0] MPI startup(): 254     186216   isix03.benchmarkcenter.megware.com  {254}
[0] MPI startup(): 255     186141   isix03.benchmarkcenter.megware.com  {255}
LAMMPS (22 Jul 2025)
  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 8 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 = 0.021 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) = 53.28 | 54.25 | 55.65 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 1.27891 on 256 procs for 10 steps with 32768000 atoms

Performance: 3.378 ns/day, 7.105 hours/ns, 7.819 timesteps/s, 256.219 Matom-step/s
98.6% CPU use with 256 MPI tasks x 1 OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.96464    | 0.99896    | 1.0449     |   1.4 | 78.11
Neigh   | 0.15236    | 0.15548    | 0.15965    |   0.3 | 12.16
Comm    | 0.02667    | 0.063255   | 0.11698    |   6.8 |  4.95
Output  | 0.0013675  | 0.0016078  | 0.0023156  |   0.4 |  0.13
Modify  | 0.019606   | 0.039474   | 0.04763    |   3.4 |  3.09
Other   |            | 0.02013    |            |       |  1.57

Nlocal:         128000 ave      128127 max      127867 min
Histogram: 4 14 23 26 63 44 35 24 16 7
Nghost:          49871 ave       50004 max       49744 min
Histogram: 7 16 23 35 43 63 27 24 13 5
Neighs:    4.81815e+06 ave 4.84288e+06 max 4.79424e+06 min
Histogram: 26 42 51 9 0 0 18 49 44 17

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) = 53.49 | 54.31 | 55.65 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 97.4609 on 256 procs for 500 steps with 32768000 atoms

Performance: 2.216 ns/day, 10.829 hours/ns, 5.130 timesteps/s, 168.108 Matom-step/s
98.8% CPU use with 256 MPI tasks x 1 OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 72.954     | 75.309     | 78.49      |  11.5 | 77.27
Neigh   | 14.111     | 14.625     | 15.556     |  10.5 | 15.01
Comm    | 1.4981     | 4.6601     | 7.8482     |  59.4 |  4.78
Output  | 0.015328   | 0.017476   | 0.019467   |   0.6 |  0.02
Modify  | 0.87269    | 1.7268     | 2.2505     |  32.2 |  1.77
Other   |            | 1.123      |            |       |  1.15

Nlocal:         128000 ave      128317 max      127675 min
Histogram: 5 16 27 35 40 42 44 23 17 7
Nghost:        49867.6 ave       50192 max       49552 min
Histogram: 7 16 24 44 41 41 35 26 17 5
Neighs:    4.83163e+06 ave 4.86159e+06 max 4.79896e+06 min
Histogram: 5 19 37 39 21 18 39 39 33 6

Total # of neighbors = 1.2368965e+09
Ave neighs/atom = 37.747084
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:01:39


Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/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_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/tools/lprof_npsu_run_0      #
#  Functions  |  Per-node      |  maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/tools/lprof_npsu_run_0  #
#  Functions  |  Per-process   |  maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/tools/lprof_npsu_run_0  #
#  Functions  |  Per-thread    |  maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/tools/lprof_npsu_run_0  #
#  Loops      |  Cluster-wide  |  maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/tools/lprof_npsu_run_0      #
#  Loops      |  Per-node      |  maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/tools/lprof_npsu_run_0  #
#  Loops      |  Per-process   |  maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/tools/lprof_npsu_run_0  #
#  Loops      |  Per-thread    |  maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3573/intel/LAMMPS/run/oneview_runs/defaults/gcc/oneview_results_1758136630/tools/lprof_npsu_run_0  #
####################################################################################################################################################################################################################

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