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<div style=""><span style="color:rgb(0,0,0); font-family:Calibri,Arial,Helvetica,sans-serif; font-size:14pt">Hello, I'm new to quantum espresso and I'm having some issues while running the examples. I installed QE in my laptop (Lenovo Thinkpad E480, i7-8550U
running Fedora 29) using intel mpi to take advantage of the quad core cpu. </span>
<span style="color:rgb(0,0,0); font-family:Calibri,Arial,Helvetica,sans-serif; font-size:14pt">I have compiled QE using the intel fortran compiler and intel C compiler including the MKL provided by the Intel Paralell Studio XE 2019 update 1 cluster edition.
No warnings or errors were shown during the compilation but when I run the example ~/qe-6.3/PW/examples/example01 it just aborts. A forum suggested to set FI_LOG_LEVEL= debug to collect logs and this is the output I get:</span></div>
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</span></div>
<div style=""><font color="#000000" face="Calibri, Arial, Helvetica, sans-serif"><span style="font-size:18.6667px">********************************************************************************************************************************************</span></font></div>
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<span style="font-family:monospace"><span style="color:#000000; background-color:#ffffff">[dbarcene@NGC2501 example01]$ ./run_example </span><br>
<br>
/home/dbarcene/qe-6.3/PW/examples/example01 : starting <br>
<br>
This example shows how to use pw.x to calculate the total energy and <br>
the band structure of four simple systems: Si, Al, Cu, Ni. <br>
<br>
executables directory: /home/dbarcene/qe-6.3/bin <br>
pseudo directory: /home/dbarcene/qe-6.3/pseudo <br>
temporary directory: /home/dbarcene/qe-6.3/tempdir <br>
checking that needed directories and files exist... done <br>
<br>
running pw.x as: mpirun -np 4 /home/dbarcene/qe-6.3/bin/pw.x -nk 1 -nd 1 -nb 1 -nt 1 <br>
<br>
running the scf calculation for Si...Abort(1094543) on node 1 (rank 1 in comm 0): Fatal error in PMPI_Init: Other MPI error, error stack:
<br>
MPIR_Init_thread(639)......: <br>
MPID_Init(860).............: <br>
MPIDI_NM_mpi_init_hook(689): OFI addrinfo() failed (ofi_init.h:689:MPIDI_NM_mpi_init_hook:No data available)
<br>
Abort(1094543) on node 2 (rank 2 in comm 0): Fatal error in PMPI_Init: Other MPI error, error stack:
<br>
MPIR_Init_thread(639)......: <br>
MPID_Init(860).............: <br>
MPIDI_NM_mpi_init_hook(689): OFI addrinfo() failed (ofi_init.h:689:MPIDI_NM_mpi_init_hook:No data available)
<br>
Abort(1094543) on node 3 (rank 3 in comm 0): Fatal error in PMPI_Init: Other MPI error, error stack:
<br>
MPIR_Init_thread(639)......: <br>
MPID_Init(860).............: <br>
MPIDI_NM_mpi_init_hook(689): OFI addrinfo() failed (ofi_init.h:689:MPIDI_NM_mpi_init_hook:No data available)
<br>
Abort(1094543) on node 0 (rank 0 in comm 0): Fatal error in PMPI_Init: Other MPI error, error stack:
<br>
MPIR_Init_thread(639)......: <br>
MPID_Init(860).............: <br>
MPIDI_NM_mpi_init_hook(689): OFI addrinfo() failed (ofi_init.h:689:MPIDI_NM_mpi_init_hook:No data available)
<br>
[cli_1]: readline failed <br>
forrtl: error (78): process killed (SIGTERM) <br>
Image PC Routine Line Source <br>
pw.x 0000000001A5EAC4 Unknown Unknown Unknown <br>
libpthread-2.28.s 00007FE6FEB3B030 Unknown Unknown Unknown <br>
pw.x 00000000011BF2F0 Unknown Unknown Unknown <br>
pw.x 0000000000CBA309 Unknown Unknown Unknown <br>
pw.x 0000000000CB9D37 Unknown Unknown Unknown <br>
pw.x 0000000000407286 Unknown Unknown Unknown <br>
pw.x 0000000000407222 Unknown Unknown Unknown <br>
libc-2.28.so 00007FE6FADC0413 __libc_start_main Unknown Unknown <br>
pw.x 000000000040712E Unknown Unknown Unknown <br>
forrtl: error (78): process killed (SIGTERM) <br>
Image PC Routine Line Source <br>
pw.x 0000000001A5EAC4 Unknown Unknown Unknown <br>
libpthread-2.28.s 00007F05A7AEF030 Unknown Unknown Unknown <br>
libpthread-2.28.s 00007F05A7AEDDC0 __read Unknown Unknown <br>
libmpi.so.12.0.0 00007F05A65D399F Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F05A65D2D32 Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F05A4C158D0 Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F05A4CC6613 MPIR_Err_return_c Unknown Unknown <br>
libmpi.so.12.0.0 00007F05A58AA299 MPI_Init Unknown Unknown <br>
libmpifort.so.12. 00007F05A40114EB MPI_INIT Unknown Unknown <br>
pw.x 0000000000CBA2F8 Unknown Unknown Unknown <br>
pw.x 0000000000CB9D37 Unknown Unknown Unknown <br>
pw.x 0000000000407286 Unknown Unknown Unknown <br>
pw.x 0000000000407222 Unknown Unknown Unknown <br>
libc-2.28.so 00007F05A3D74413 __libc_start_main Unknown Unknown <br>
pw.x 000000000040712E Unknown Unknown Unknown <br>
forrtl: error (78): process killed (SIGTERM) <br>
Image PC Routine Line Source <br>
pw.x 0000000001A5EAC4 Unknown Unknown Unknown <br>
libpthread-2.28.s 00007F73A282A030 Unknown Unknown Unknown <br>
libpthread-2.28.s 00007F73A2828DC0 __read Unknown Unknown <br>
libmpi.so.12.0.0 00007F73A130E99F Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F73A130DD32 Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F739F9508D0 Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F739FA01613 MPIR_Err_return_c Unknown Unknown <br>
libmpi.so.12.0.0 00007F73A05E5299 MPI_Init Unknown Unknown <br>
libmpifort.so.12. 00007F739ED4C4EB MPI_INIT Unknown Unknown <br>
pw.x 0000000000CBA2F8 Unknown Unknown Unknown <br>
pw.x 0000000000CB9D37 Unknown Unknown Unknown <br>
pw.x 0000000000407286 Unknown Unknown Unknown <br>
pw.x 0000000000407222 Unknown Unknown Unknown <br>
libc-2.28.so 00007F739EAAF413 __libc_start_main Unknown Unknown <br>
pw.x 000000000040712E Unknown Unknown Unknown <br>
forrtl: error (78): process killed (SIGTERM) <br>
Image PC Routine Line Source <br>
pw.x 0000000001A5EAC4 Unknown Unknown Unknown <br>
libpthread-2.28.s 00007F114000F030 Unknown Unknown Unknown <br>
libpthread-2.28.s 00007F114000DDC0 __read Unknown Unknown <br>
libmpi.so.12.0.0 00007F113EAF399F Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F113EAF2D32 Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F113D1358D0 Unknown Unknown Unknown <br>
libmpi.so.12.0.0 00007F113D1E6613 MPIR_Err_return_c Unknown Unknown <br>
libmpi.so.12.0.0 00007F113DDCA299 MPI_Init Unknown Unknown <br>
libmpifort.so.12. 00007F113C5314EB MPI_INIT Unknown Unknown <br>
pw.x 0000000000CBA2F8 Unknown Unknown Unknown <br>
pw.x 0000000000CB9D37 Unknown Unknown Unknown <br>
pw.x 0000000000407286 Unknown Unknown Unknown <br>
pw.x 0000000000407222 Unknown Unknown Unknown <br>
libc-2.28.so 00007F113C294413 __libc_start_main Unknown Unknown <br>
pw.x 000000000040712E Unknown Unknown Unknown <br>
Error condition encountered during test: exit status = 179 <br>
Aborting</span></div>
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<span style="font-family:monospace">***************************************************************************************************************************************</span></div>
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<span style="font-family:monospace">Thanks in advance for any help you may provide.</span></div>
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<span style="font-family:monospace">All the best</span></div>
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<span style="font-family:monospace">David Barcene<br>
</span><br>
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