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Building OpenMX latest with Intel
Date: 2022/06/15 03:17
Name: Grigory Shamov   <Grigory.Shamov@umanitoba.ca>

Hi,

We have tried to build OpenMX patch 3.9.9 with Intel compilers and openMPI, on Linux.

It fails for some "DSO object missing" at linking stage. Looks like adding -lifcore to the LIBS fixes this (if using the top of the makefile example; it has some -lifcore in commented out lines below).

LIB= -L$(MKLROOT)/lib/intel64 -lmkl_scalapack_lp64 -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -lmkl_blacs_openmpi_lp64 -lmpi_usempif08 -lmpi_usempi_ignore_tkr -lmpi_mpifh -liomp5 -lifcore -lpthread -lm -ldl
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Re: Building OpenMX latest with Intel ( No.1 )
Date: 2022/06/16 10:04
Name: T. Ozaki

Hi,

I wonder that you know the following website:

https://www.intel.com/content/www/us/en/developer/tools/oneapi/onemkl-link-line-advisor.html#gs.3r3lnu

which suggests a proper setting for the compilation.

Regards,

TO
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