[QE-users] pw.x Error for QE6.4

[venky ch]

Dear QE users,

I forgot to send you the make.inc file related to this error. kindly find
the attached one.

The configuration was done using this command as given below.

"./configure  FC=ifort F77=ifort MPICC=mpiicc MPIF90=mpiifort CC=icc
--with-scalapack=intelmpi"

thanks
venkatesh

On Sat, Jul 31, 2021 at 1:10 AM venky ch <chvenkateshphy at gmail.com> wrote:

>
> Hi everyone, I tried to install QE 6.4 and got an error message while
> running pw.x with mpiifort as given below. Kindly help me to resolve the
> issue.
>
> thanks
> venkatesh
>
>
> ===========
> mpiifort -static-intel -o pw.x \
>            pwscf.o  libpw.a ../../Modules/libqemod.a
> ../../KS_Solvers/libks_solvers.a ../../FFTXlib/libqefft.a
> ../../LAXlib/libqela.a ../../UtilXlib/libutil.a ../../dft-d3/libdftd3qe.a
> /home/proj/21/isuch/soft/QE/q-e-qe-6.4//clib/clib.a
>  /home/proj/21/isuch/soft/QE/q-e-qe-6.4//iotk/src/libiotk.a
>  -lmkl_scalapack_lp64 -lmkl_blacs_intelmpi_lp64
>  -L/home/proj/21/isuch/soft/QE/q-e-qe-6.4//FoX/lib  -lFoX_dom -lFoX_sax
> -lFoX_wxml -lFoX_common -lFoX_utils -lFoX_fsys
>  -L/home/proj/21/isuch/soft/fftw/lib -lfftw3  -lmkl_intel_lp64
>  -lmkl_sequential -lmkl_core -L/opt/intel/impi/4.1.0.024/intel64/lib
> -L/home/proj/21/isuch/soft/libxc_install/lib/ -lxcf90 -lxc
> ../../Modules/libqemod.a(functionals.o): In function `slater':
>
>
> ../../Modules/libqemod.a(functionals.o): In function `slater':
> /home/proj/21/isuch/soft/QE/q-e-qe-6.4/Modules/functionals.f90:31:
> undefined reference to `xc_f90_func_init_'
> /home/proj/21/isuch/soft/QE/q-e-qe-6.4/Modules/functionals.f90:32:
> undefined reference to `xc_f90_lda_exc_vxc_'
> /home/proj/21/isuch/soft/QE/q-e-qe-6.4/Modules/functionals.f90:33:
> undefined reference to `xc_f90_func_end_'
> ../../Modules/libqemod.a(functionals.o): In function `pz':
>
>
> ============
>
>
>
>
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