Total # of neighbors = 2674961 Ave neighs/atom = 466.34606 Neighbor list builds = 0 Dangerous builds = 0 Setting up Verlet run ... Unit style : real Current step : 3 Time step : 0.1 Per MPI rank memory allocation (min/avg/max) = 185.5 | 186.3 | 186.9 Mbytes Step Temp E_pair E_mol TotEng Press 3 0 -623578.61 0 -623578.61 120434.61 [:24107] *** Process received signal *** [:24107] Signal: Segmentation fault (11) [:24107] Signal code: Address not mapped (1) [:24107] Failing at address: 0x38 [:24109] *** Process received signal *** [:24109] Signal: Segmentation fault (11) [:24109] Signal code: Address not mapped (1) [:24109] Failing at address: 0x38 [:24110] *** Process received signal *** [:24110] Signal: Segmentation fault (11) [:24110] Signal code: Address not mapped (1) [:24110] Failing at address: 0x38 [:24108] *** Process received signal *** [:24108] Signal: Segmentation fault (11) [:24108] Signal code: Address not mapped (1) [:24108] Failing at address: 0x38 [:24108] [ 0] /lib64/libpthread.so.0[0x3e4ba0f130] [:24108] [ 1] lmp_mpi[0x13afff6] [:24108] [ 2] [mjana:24107] [ 0] lmp_mpi[0x13a67df] [:24108] [ 3] lmp_mpi[0x121f6c9] [:24108] [ 4] lmp_mpi[0x5c8d2d] [:24108] [ 5] lmp_mpi[0x55b6b9] [:24108] [ 6] lmp_mpi[0x425f9f] [:24108] [ 7] lmp_mpi[0x426b3d] [:24108] [ 8] lmp_mpi[0x407db8] [:24108] [ 9] /lib64/libpthread.so.0[0x3e4ba0f130] [:24107] [ 1] lmp_mpi[0x13afff6] [:24107] [ 2] lmp_mpi[0x13a67df] [:24107] [ 3] lmp_mpi[0x121f6c9] [:24107] /lib64/libc.so.6(__libc_start_main+0xf5)[0x3e4b221b45] [:24108] [10] lmp_mpi[0x409be1] [:24108] *** End of error message *** [ 4] lmp_mpi[0x5c8d2d] [:24107] [ 5] lmp_mpi[0x55b6b9] [:24107] [ 6] lmp_mpi[0x425f9f] [:24107] [ 7] lmp_mpi[0x426b3d] [:24107] [ 8] lmp_mpi[0x407db8] [:24107] [ 9] /lib64/libc.so.6(__libc_start_main+0xf5)[0x3e4b221b45] [:24107] [10] lmp_mpi[0x409be1] [:24107] *** End of error message *** [:24110] [mjana:24109] [ 0] /lib64/libpthread.so.0[0x3e4ba0f130] [:24110] [ 1] lmp_mpi[0x13afff6] [:24110] [ 2] lmp_mpi[0x13a67df] [:24110] [ 3] lmp_mpi[0x121f6c9] [:24110] [ 4] lmp_mpi[0x5c8d2d] [:24110] [ 5] [ 0] /lib64/libpthread.so.0[0x3e4ba0f130] [:24109] [ 1] lmp_mpi[0x13afff6] [:24109] [ 2] lmp_mpi[0x13a67df] lmp_mpi[0x55b6b9] [:24110] [ 6] lmp_mpi[0x425f9f] [:24110] [ 7] lmp_mpi[0x426b3d] [:24110] [ 8] lmp_mpi[0x407db8] [:24110] [ 9] [mjana:24109] [ 3] lmp_mpi[0x121f6c9] [:24109] [ 4] lmp_mpi[0x5c8d2d] [:24109] [ 5] lmp_mpi[0x55b6b9] [:24109] [ 6] lmp_mpi[0x425f9f] [:24109] [ 7] lmp_mpi[0x426b3d] [:24109] [ 8] lmp_mpi[0x407db8] [:24109] [ 9] /lib64/libc.so.6(__libc_start_main+0xf5)[0x3e4b221b45] [:24110] [10] lmp_mpi[0x409be1] [:24110] *** End of error message *** /lib64/libc.so.6(__libc_start_main+0xf5)[0x3e4b221b45] [:24109] [10] lmp_mpi[0x409be1] [:24109] *** End of error message *** -------------------------------------------------------------------------- Primary job terminated normally, but 1 process returned a non-zero exit code. Per user-direction, the job has been aborted. -------------------------------------------------------------------------- -------------------------------------------------------------------------- mpiexec noticed that process rank 3 with PID 0 on node *---* exited on signal 11 (Segmentation fault). LMP_SERIAL executable error Total # of neighbors = 2316021 Ave neighs/atom = 403.76935 Neighbor list builds = 0 Dangerous builds = 0 Setting up Verlet run ... Unit style : real Current step : 3 Time step : 0.1 Per MPI rank memory allocation (min/avg/max) = 398 | 398 | 398 Mbytes Step Temp E_pair E_mol TotEng Press 3 0 -623578.61 0 -623578.61 120434.61 Segmentation fault (core dumped)