Re: CP2K 4.1 compile error with libint (with intel 2016 update 3, libint 1.1.4, elpa 2016.05.004, and libxc 3.0.0)

jian... at gmail.com jian... at gmail.com
Tue Jan 3 16:17:35 CET 2017


Hi Andreas,
As you suggested, cp2k work!

Thank you!

ldd 
/public/software/cp2k/cp2k-4.1/exe/my-x86-64-intel-libxc-libint-elpa/cp2k.popt
        linux-vdso.so.1 =>  (0x00007fff9eb6f000)
        libpthread.so.0 => /lib64/libpthread.so.0 (0x00000037b6600000)
        libm.so.6 => /lib64/libm.so.6 (0x00000037b6a00000)
        libelpa.so.4 => 
/public/software/cp2k/elpa/201605004/lib/libelpa.so.4 (0x00007f6219116000)
        libstdc++.so.6 => /usr/lib64/libstdc++.so.6 (0x00000037bce00000)
        libmpifort.so.12 => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/mpi/intel64/lib/libmpifort.so.12 
(0x00007f6218d78000)
        libmpi.so.12 => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/mpi/intel64/lib/libmpi.so.12 
(0x00007f62185a8000)
        libdl.so.2 => /lib64/libdl.so.2 (0x00000037b5e00000)
        librt.so.1 => /lib64/librt.so.1 (0x00000037b7200000)
        libc.so.6 => /lib64/libc.so.6 (0x00000037b6200000)
        libgcc_s.so.1 => /lib64/libgcc_s.so.1 (0x00000037bc600000)
        /lib64/ld-linux-x86-64.so.2 (0x00000037b5a00000)
        libmkl_scalapack_lp64.so => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/mkl/lib/intel64/libmkl_scalapack_lp64.so 
(0x00007f6217cc3000)
        libmkl_intel_lp64.so => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/mkl/lib/intel64/libmkl_intel_lp64.so 
(0x00007f62171b2000)
        libmkl_sequential.so => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/mkl/lib/intel64/libmkl_sequential.so 
(0x00007f62164d9000)
        libmkl_core.so => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/mkl/lib/intel64/libmkl_core.so 
(0x00007f6214ac8000)
        libmkl_blacs_intelmpi_lp64.so => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/mkl/lib/intel64/libmkl_blacs_intelmpi_lp64.so 
(0x00007f621488b000)
        libifport.so.5 => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/compiler/lib/intel64/libifport.so.5 
(0x00007f621465c000)
        libifcore.so.5 => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/compiler/lib/intel64/libifcore.so.5 
(0x00007f62142f6000)
        libimf.so => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/compiler/lib/intel64/libimf.so 
(0x00007f6213df8000)
        libsvml.so => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/compiler/lib/intel64/libsvml.so 
(0x00007f6212eec000)
        libintlc.so.5 => 
/public/software/intel2016/compilers_and_libraries_2016.3.210/linux/compiler/lib/intel64/libintlc.so.5 
(0x00007f6212c7f000)

Best regards,
zj.



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