Dear all,
I moved to a new HPC, hence need install QE from scratch.
*In configuration step*, the MKL lib that I need was found successfully as
shown below:
The following libraries have been found:
BLAS_LIBS=-L/opt/intel/mkl/10.2.5.035/lib/em64t -lmkl_blas95_lp64.a
-lmkl_core.a -lmkl_sequential.a
LAPACK_LIBS=-L/opt/intel/mkl/10.2.5.035/lib/em64t -lmkl_lapack95_lp64.a
SCALAPACK_LIBS=-L/opt/intel/mkl/10.2.5.035/lib/em64t
-lmkl_scalapack_lp64.a
FFT_LIBS=
Please check if this is what you expect.
*The second step *followed as make all. *However, it gave some errors about
scalapack.*
pwscf.o libpw.a ../../Modules/libqemod.a ../../flib/ptools.a
../../flib/flib.a ../../clib/clib.a ../../iotk/src/libiotk.a
-L/opt/intel/mkl/10.2.5.035/lib/em64t -lmkl_scalapack_lp64.a
-L/opt/intel/mkl/10.2.5.035/lib/em64t -lmkl_lapack95_lp64.a
-L/opt/intel/mkl/10.2.5.035/lib/em64t -lmkl_blas95_lp64.a -lmkl_core.a
-lmkl_sequential.a
ld: *cannot find -lmkl_scalapack_lp64.a*
make[2]: *** [pw.x] Error 1
make[2]: Leaving directory `/home/user/pwscf/espresso-5.0.2/PW/src'
make[1]: *** [pw] Error 2
make[1]: Leaving directory `/home/user/pwscf/espresso-5.0.2/PW'
make: *** [pw] Error 2
I am very sure that *there
are libmkl_scalapack_lp64.a, libmkl_scalapack_lp64.so files in this
directory and they can work for other programs*.
Has anyone encountered with this error before? I googled this error but
hasn't get a solution. Hope to get some advice here.
Thank you!
Bests
Fang
--
------------------------------------------------------------------------------------------------------------
Yue-Wen FANG, PhD candidate
Key Laboratory of Polar Materials and Devices, Ministry of Education
<http://clpm.ecnu.edu.cn/>
East China Normal University <http://english.ecnu.edu.cn/>
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