Dear all, after reading up on the possibility to calculate "bulk projected bands" I found that thermo_pw should be able to do this. However I am unable to compile the latest version with qe 6.3.
My ./configure log is attached. I can build the entire QE package (except yambo - that one never works out of the box) using intel MKL and compilers by issuing *./configure --enable-shared --enable-parallel --with-scalapack=intel CC=mpicc F77=mpif90 FC=mpif90* (alternative mpifort seems to be working as well) *The following libraries have been found:* * BLAS_LIBS= -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core* * LAPACK_LIBS=* * SCALAPACK_LIBS=-lmkl_scalapack_lp64 -lmkl_blacs_intelmpi_lp64* * FFT_LIBS=-L/opt/intel/compilers_and_libraries_2018.0.128/linux/mkl/intel64* *Please check if this is what you expect.* after patching thermo_pw into QE (make join_qe) make thermo_pw fails initially with a truncation error *phdos_module.f90:392:132: Error: Line truncated at (1) [-Werror=line-truncation]* *f951: some warnings being treated as errors* which can be overcome by using -ffree-line-length-none but then make fails again whilst looking for a module called wavefunctions_module.mod which, apparently does not exist in QE/Modules *add_zstar_ue.f90:20:6:* * USE wavefunctions_module, ONLY: evc* * 1* *Fatal Error: Can't open module file ‘wavefunctions_module.mod’ for reading at (1): No such file or directory* *compilation terminated.* *make[2]: *** [add_zstar_ue.o] Error 1* *make[1]: *** [thermo_qe] Error 1* *make: *** [thermo_pw] Error 1* Has anyone encountered (and overcome..) this problem? Any hint is greatly appreciated! Best, Chris -- Postdoctoral Researcher Center for Quantum Nanoscience, Institute for Basic Science Ewha Womans University, Seoul, South Korea
test -d bin || mkdir bin
( cd clib ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/clib'
make[1]: Nothing to be done for 'all'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/clib'
cd install ; make -f extlibs_makefile libiotk
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
if test ! -d ../S3DE; then \
(gzip -dc ../archive/iotk-1.2.beta.tar.gz | (cd ../; tar -xvf -)) ; \
if test -e Makefile_iotk; then \
(cp Makefile_iotk ../S3DE/iotk/src/Makefile); fi; \
if test -e iotk_config.h; then \
(cp iotk_config.h ../S3DE/iotk/include/iotk_config.h); fi; fi
cd ../S3DE/iotk/src; make lib+util;
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
make[2]: Nothing to be done for 'lib+util'.
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
cd ../bin; ln -fs ../S3DE/iotk/tools/iotk .; \
ln -fs ../S3DE/iotk/src/iotk.x .; \
ln -fs ../S3DE/iotk/src/iotk_print_kinds.x .; \
# middle instruction needed for windows
cd ../; rm -rf iotk ; ln -fs S3DE/iotk iotk
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
cd install ; make -f extlibs_makefile libfox
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
echo
if test ! -d ../FoX; then \
mkdir ../FoX; \
(gzip -dc ../archive/fox.tgz | (cd ../FoX; tar -xvf -)); \
cd ../FoX/fox/; export FC=gfortran; export FCFLAGS=""; \
./configure --prefix=/home/chris/Downloads/qe-6.3/q-e//FoX ;\
make install; cd ../; rm -fr fox;fi
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
( cd UtilXlib ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
make[1]: Nothing to be done for 'all'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
cd install ; make -f extlibs_makefile liblapack
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
touch fake_liblapack.a
rm fake_liblapack.a
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
cd install ; make -f extlibs_makefile libcuda
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
make[1]: Nothing to be done for 'libcuda'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
( cd LAXlib ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
make[1]: Nothing to be done for 'all'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
( cd FFTXlib ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
make[1]: Nothing to be done for 'all'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
( cd Modules ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
make[1]: Nothing to be done for 'all'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
( cd KS_Solvers/Davidson ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
make[1]: Nothing to be done for 'all'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
( cd KS_Solvers/CG ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
make[1]: Nothing to be done for 'all'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
( cd dft-d3 ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/dft-d3'
if test -n "" ; then \
( cd ../; make || exit 1 ) ; fi
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/dft-d3'
if test -d PW ; then \
( cd PW ; make TLDEPS= all || exit 1) ; fi
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW'
( cd src ; make all || exit 1 )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW/src'
if test -n "" ; then \
( cd ../.. ; make || exit 1 ) ; fi
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW/src'
( cd tools ; make all || exit 1 )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW/tools'
if test -n "" ; then \
( cd ../.. ; make || exit 1 ) ; fi
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW/tools'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW'
if test -d PP ; then \
( cd PP ; make TLDEPS= all || exit 1 ) ; fi
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PP'
if test -d src ; then \
( cd src ; make || exit 1 ) ; fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PP/src'
if test -n "" ; then \
( cd ../.. ; make || exit 1 ) ; fi
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PP/src'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PP'
( cd LR_Modules ; make TLDEPS= all || exit 1 )
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/LR_Modules'
make[1]: Nothing to be done for 'all'.
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/LR_Modules'
if test -d PHonon; then \
(cd PHonon; make all || exit 1) ; fi
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PHonon'
( cd PH ; make all || exit 1 )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/PH'
if test -n "bindir libs mods libdavid libcg lrmods" ; then \
( cd ../.. ; make bindir libs mods libdavid libcg lrmods || exit 1 ) ; fi
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e'
test -d bin || mkdir bin
( cd clib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/clib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/clib'
cd install ; make -f extlibs_makefile libiotk
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
if test ! -d ../S3DE; then \
(gzip -dc ../archive/iotk-1.2.beta.tar.gz | (cd ../; tar -xvf -)) ; \
if test -e Makefile_iotk; then \
(cp Makefile_iotk ../S3DE/iotk/src/Makefile); fi; \
if test -e iotk_config.h; then \
(cp iotk_config.h ../S3DE/iotk/include/iotk_config.h); fi; fi
cd ../S3DE/iotk/src; make lib+util;
make[5]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
make[5]: Nothing to be done for 'lib+util'.
make[5]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
cd ../bin; ln -fs ../S3DE/iotk/tools/iotk .; \
ln -fs ../S3DE/iotk/src/iotk.x .; \
ln -fs ../S3DE/iotk/src/iotk_print_kinds.x .; \
# middle instruction needed for windows
cd ../; rm -rf iotk ; ln -fs S3DE/iotk iotk
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
cd install ; make -f extlibs_makefile libfox
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
echo
if test ! -d ../FoX; then \
mkdir ../FoX; \
(gzip -dc ../archive/fox.tgz | (cd ../FoX; tar -xvf -)); \
cd ../FoX/fox/; export FC=gfortran; export FCFLAGS=""; \
./configure --prefix=/home/chris/Downloads/qe-6.3/q-e//FoX ;\
make install; cd ../; rm -fr fox;fi
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
( cd UtilXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
cd install ; make -f extlibs_makefile liblapack
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
touch fake_liblapack.a
rm fake_liblapack.a
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
cd install ; make -f extlibs_makefile libcuda
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
make[4]: Nothing to be done for 'libcuda'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
( cd LAXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
( cd FFTXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
( cd Modules ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
( cd KS_Solvers/Davidson ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
( cd KS_Solvers/CG ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
( cd LR_Modules ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/LR_Modules'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/LR_Modules'
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e'
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/PH'
( cd Gamma ; make all || exit 1 )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/Gamma'
if test -n "bindir mods libs pw" ; then \
( cd ../.. ; make bindir mods libs pw || exit 1 ) ; fi
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e'
test -d bin || mkdir bin
cd install ; make -f extlibs_makefile libiotk
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
if test ! -d ../S3DE; then \
(gzip -dc ../archive/iotk-1.2.beta.tar.gz | (cd ../; tar -xvf -)) ; \
if test -e Makefile_iotk; then \
(cp Makefile_iotk ../S3DE/iotk/src/Makefile); fi; \
if test -e iotk_config.h; then \
(cp iotk_config.h ../S3DE/iotk/include/iotk_config.h); fi; fi
cd ../S3DE/iotk/src; make lib+util;
make[5]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
make[5]: Nothing to be done for 'lib+util'.
make[5]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
cd ../bin; ln -fs ../S3DE/iotk/tools/iotk .; \
ln -fs ../S3DE/iotk/src/iotk.x .; \
ln -fs ../S3DE/iotk/src/iotk_print_kinds.x .; \
# middle instruction needed for windows
cd ../; rm -rf iotk ; ln -fs S3DE/iotk iotk
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
cd install ; make -f extlibs_makefile libfox
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
echo
if test ! -d ../FoX; then \
mkdir ../FoX; \
(gzip -dc ../archive/fox.tgz | (cd ../FoX; tar -xvf -)); \
cd ../FoX/fox/; export FC=gfortran; export FCFLAGS=""; \
./configure --prefix=/home/chris/Downloads/qe-6.3/q-e//FoX ;\
make install; cd ../; rm -fr fox;fi
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
( cd UtilXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
cd install ; make -f extlibs_makefile liblapack
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
touch fake_liblapack.a
rm fake_liblapack.a
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
cd install ; make -f extlibs_makefile libcuda
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
make[4]: Nothing to be done for 'libcuda'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
( cd LAXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
( cd FFTXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
( cd Modules ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
( cd clib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/clib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/clib'
( cd KS_Solvers/Davidson ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
( cd KS_Solvers/CG ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
( cd dft-d3 ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/dft-d3'
if test -n "" ; then \
( cd ../; make || exit 1 ) ; fi
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/dft-d3'
if test -d PW ; then \
( cd PW ; make TLDEPS= all || exit 1) ; fi
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW'
( cd src ; make all || exit 1 )
make[5]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW/src'
if test -n "" ; then \
( cd ../.. ; make || exit 1 ) ; fi
make[5]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW/src'
( cd tools ; make all || exit 1 )
make[5]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW/tools'
if test -n "" ; then \
( cd ../.. ; make || exit 1 ) ; fi
make[5]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW/tools'
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW'
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e'
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/Gamma'
( cd FD ; make all || exit 1 )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/FD'
if test -n "bindir libs pw" ; then \
( cd ../.. ; make bindir libs pw || exit 1 ) ; fi
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e'
test -d bin || mkdir bin
( cd clib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/clib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/clib'
cd install ; make -f extlibs_makefile libiotk
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
if test ! -d ../S3DE; then \
(gzip -dc ../archive/iotk-1.2.beta.tar.gz | (cd ../; tar -xvf -)) ; \
if test -e Makefile_iotk; then \
(cp Makefile_iotk ../S3DE/iotk/src/Makefile); fi; \
if test -e iotk_config.h; then \
(cp iotk_config.h ../S3DE/iotk/include/iotk_config.h); fi; fi
cd ../S3DE/iotk/src; make lib+util;
make[5]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
make[5]: Nothing to be done for 'lib+util'.
make[5]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
cd ../bin; ln -fs ../S3DE/iotk/tools/iotk .; \
ln -fs ../S3DE/iotk/src/iotk.x .; \
ln -fs ../S3DE/iotk/src/iotk_print_kinds.x .; \
# middle instruction needed for windows
cd ../; rm -rf iotk ; ln -fs S3DE/iotk iotk
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
cd install ; make -f extlibs_makefile libfox
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
echo
if test ! -d ../FoX; then \
mkdir ../FoX; \
(gzip -dc ../archive/fox.tgz | (cd ../FoX; tar -xvf -)); \
cd ../FoX/fox/; export FC=gfortran; export FCFLAGS=""; \
./configure --prefix=/home/chris/Downloads/qe-6.3/q-e//FoX ;\
make install; cd ../; rm -fr fox;fi
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
( cd UtilXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
cd install ; make -f extlibs_makefile liblapack
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
touch fake_liblapack.a
rm fake_liblapack.a
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
cd install ; make -f extlibs_makefile libcuda
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
make[4]: Nothing to be done for 'libcuda'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
( cd LAXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
( cd FFTXlib ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
( cd Modules ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
( cd KS_Solvers/Davidson ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
( cd KS_Solvers/CG ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
make[4]: Nothing to be done for 'all'.
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
( cd dft-d3 ; make TLDEPS= all || exit 1 )
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/dft-d3'
if test -n "" ; then \
( cd ../; make || exit 1 ) ; fi
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/dft-d3'
if test -d PW ; then \
( cd PW ; make TLDEPS= all || exit 1) ; fi
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW'
( cd src ; make all || exit 1 )
make[5]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW/src'
if test -n "" ; then \
( cd ../.. ; make || exit 1 ) ; fi
make[5]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW/src'
( cd tools ; make all || exit 1 )
make[5]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW/tools'
if test -n "" ; then \
( cd ../.. ; make || exit 1 ) ; fi
make[5]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW/tools'
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW'
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e'
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/FD'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PHonon'
if test -d thermo_pw; then \
(cd thermo_pw; make all || exit 1) ; fi
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/thermo_pw'
( cd lib ; make all || exit 1 )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/thermo_pw/lib'
make[2]: Nothing to be done for 'all'.
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/thermo_pw/lib'
( cd qe ; make all || exit 1 )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/thermo_pw/qe'
mpif90 -O3 -g -ffree-line-length-none -x f95-cpp-input -D__DFTI -D__MPI -D__SCALAPACK -I/home/chris/Downloads/qe-6.3/q-e//include -I/home/chris/Downloads/qe-6.3/q-e//FoX/finclude -I/home/chris/Downloads/qe-6.3/q-e//S3DE/iotk/include/ -I/opt/intel/mkl/include -I/home/chris/Downloads/qe-6.3/q-e//iotk/src -I/home/chris/Downloads/qe-6.3/q-e//Modules -I/home/chris/Downloads/qe-6.3/q-e//FFTXlib -I/home/chris/Downloads/qe-6.3/q-e//LAXlib -I/home/chris/Downloads/qe-6.3/q-e//UtilXlib -I/home/chris/Downloads/qe-6.3/q-e//FoX/finclude -I../../PW/src -I../../LR_Modules -I../../PHonon/PH -I../lib -I. -c add_zstar_ue.f90
../../make.inc:16: recipe for target 'add_zstar_ue.o' failed
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/thermo_pw/qe'
Makefile:19: recipe for target 'thermo_qe' failed
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/thermo_pw'
Makefile:82: recipe for target 'thermo_pw' failed
touch make.inc
for dir in \
CPV LAXlib FFTXlib UtilXlib Modules PP PW EPW \
KS_Solvers/CG KS_Solvers/Davidson KS_Solvers/Davidson_RCI \
NEB ACFDT COUPLE GWW XSpectra PWCOND dft-d3 \
atomic clib LR_Modules pwtools upftools \
dev-tools extlibs Environ TDDFPT PHonon GWW \
; do \
if test -d $dir ; then \
( cd $dir ; \
make TLDEPS= clean ) \
fi \
done
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/CPV'
( cd src ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/CPV/src'
/bin/rm -f cppp.x *.o *.mod cpver.h *.i core* *_tmp.f90 fort* \
*.cpp *.d *.L *.a *.s cp.x manycp.x wfdd.x
/bin/rm -rf ../../bin/manycp.x ../../bin/cppp.x ../../bin/cp.x ../../bin/wfdd.x
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/CPV/src'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/CPV'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
/bin/rm -f *.o *.a *.d *.i *~ *_tmp.f90 *.mod *.L *.x
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/LAXlib'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
/bin/rm -f *.o *.a *.d *.i *~ *_tmp.f90 *.mod *.L
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/FFTXlib'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
/bin/rm -f *.o *.a *.d *.i *~ *_tmp.f90 *.mod *.L *.x
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/UtilXlib'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
/bin/rm -f *.o *.a *.d *.i *~ *_tmp.f90 *.mod *.L
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/Modules'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PP'
if test -d examples ; then \
( cd examples ; ./clean_all ) ; fi
if test -d src ; then \
( cd src ; make clean ) ; fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PP/src'
/bin/rm -f *.x *.o *~ *_tmp.f90 *.d *.mod *.i *.L libpp.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PP/src'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PP'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW'
if test -d examples ; then \
( cd examples ; ./clean_all ) ; fi
( cd src ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW/src'
/bin/rm -f *.x *.o *.a *~ *_tmp.f90 *.d *.mod *.i *.L
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW/src'
( cd tools ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PW/tools'
/bin/rm -f pwi2xsf pwi2xsf_old *.x *.o *~ *_tmp.f90 *.mod *.d *.i *.L
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW/tools'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PW'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/EPW'
cd src ; rm -f *.o *.mod *~ *.F90
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/EPW'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
/bin/rm -f *.o *.a *.d *.i *~ *_tmp.f90 *.mod *.L *.x
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/CG'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
/bin/rm -f *.o *.a *.d *.i *~ *_tmp.f90 *.mod *.L *.x
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson_RCI'
/bin/rm -f *.o *.a *.d *.i *~ *_tmp.f90 *.mod *.L *.x
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/KS_Solvers/Davidson_RCI'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/NEB'
if test -d examples ; then \
( cd examples ; ./clean_all ) ; fi
if test -d src ; then \
( cd src ; make clean ) ; fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/NEB/src'
/bin/rm -f *.x *.o *.a *~ *_tmp.f90 *.d *.mod *.i *.L
/bin/rm -f ../../bin/neb.x
/bin/rm -f ../../bin/path_interpolation.x
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/NEB/src'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/NEB'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/COUPLE'
if test -d examples ; then \
( cd examples ; make -f Makefile.gfortran clean ) ; fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/COUPLE/examples'
/bin/rm -f *.x *.o *.a *~ *.F90 *.d *.mod *.i *.L
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/COUPLE/examples'
if test -d tests ; then \
( cd tests ; ./clean_all ) ; fi
if test -d src ; then \
( cd src ; make clean ) ; fi ;\
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/COUPLE/src'
/bin/rm -f *.x *.o *.a *~ *_tmp.f90 *.d *.mod *.i *.L
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/COUPLE/src'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/COUPLE'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW'
( cd pw4gww ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/pw4gww'
/bin/rm -fv *.x *.o *~ *_tmp.f90 *.d *.mod *.i *.L libpw4gww.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/pw4gww'
( cd head ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/head'
/bin/rm -fv *.x *.o *.a *~ *_tmp.f90 *.d *.mod *.i *.L
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/head'
( cd gww ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/gww'
/bin/rm -f -v gww.x gww_fit.x *.o *~ *_tmp.f90 *.d *.mod *.i *.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/gww'
( cd minpack ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/minpack'
/bin/rm -fv minpacklib.a *.o
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/minpack'
( cd bse ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/bse'
/bin/rm -f *.x *.o *~ *_tmp.f90 *.d *.mod *.i *.L libbse.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/bse'
( cd simple ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple'
/bin/rm -f *.x *.o *~ *.F90 *.d *.mod *.i *.L libsimple.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple'
( cd simple_bse ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple_bse'
/bin/rm -f -v simple_bse.x *.o *~ *.F90 *.d *.mod *.i work.pc
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple_bse'
( cd simple_ip ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple_ip'
/bin/rm -f -v simple_ip.x *.o *~ *.F90 *.d *.mod *.i work.pc
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple_ip'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/XSpectra'
( cd src ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/XSpectra/src'
/bin/rm -f *.x *.o *~ *_tmp.f90 *.d *.mod *.i *.L
/bin/rm -f ../../bin/xspectra.x
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/XSpectra/src'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/XSpectra'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PWCOND'
if test -d examples ; then \
( cd examples ; ./clean_all ) ; fi
( cd src ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PWCOND/src'
/bin/rm -f *.x *.o *~ *_tmp.f90 *.d *.mod *.i *.a *.L
/bin/rm -f ../../bin/pwcond.x
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PWCOND/src'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PWCOND'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/dft-d3'
( /bin/rm -f *.o *.a *.d *.i *.x *~ *_tmp.f90 *.mod *.L ); \
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/dft-d3'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/atomic'
if test -d examples ; then \
( cd examples ; ./make_clean ) ; fi
cleaning all : done
if test -d pseudo_library ; then \
( cd pseudo_library ; ./make_clean) ; fi
( cd src ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/atomic/src'
/bin/rm -f *.o *_tmp.f90 *.x *~ *.d *.mod *.tmp.* *.L
/bin/rm -f ../../bin/ld1.x
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/atomic/src'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/atomic'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/clib'
rm -f clib.a *.o *.mod *.i core*
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/clib'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/LR_Modules'
/bin/rm -f *.o *.a *.d *.i *~ *_tmp.f90 *.mod *.L
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/LR_Modules'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/upftools'
/bin/rm -f *.x *.o *~ *_tmp.f90 *.mod *.d *.i *.L
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/upftools'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/dev-tools'
rm INPUT_*.xml INPUT_*.xml.tcl *-help.tcl
Makefile:32: recipe for target 'clean' failed
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/dev-tools'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/TDDFPT'
( cd src ; make clean ; )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/TDDFPT/src'
/bin/rm -f ../bin/turbo_lanczos.x ../bin/turbo_davidson.x ../bin/turbo_eels.x *.x *.o *~ *.d *.mod *.i work.pc *.a *_tmp.f90
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/TDDFPT/src'
( cd tools ; make clean ; )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/TDDFPT/tools'
rm -f ../bin/turbo_spectrum.x *.x *.o *.mod *_tmp.f90
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/TDDFPT/tools'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/TDDFPT'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PHonon'
( cd PH ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/PH'
/bin/rm -f *.x *.o *.a *~ *_tmp.f90 *.d *.mod *.i *.L
/bin/rm -rf ../../bin/ph.x ../../bin/dynmat.x ../../bin/matdyn.x \
../../bin/q2r.x ../../bin/q2trans.x ../../bin/q2trans_fd.x ../../bin/lambda.x ../../bin/fqha.x \
../../bin/alpha2f.x ../../disp_width.x
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/PH'
( cd Gamma ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/Gamma'
/bin/rm -f *.x *.o *.d *.i *~ *_tmp.f90 *.mod *.L *.a
/bin/rm -f ../../bin/phcg.x
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/Gamma'
if test -d examples ; then \
( cd examples ; ./clean_all ) ; fi
( cd FD ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/FD'
/bin/rm -f *.x *.o *~ *_tmp.f90 *.d *.mod *.i *.L libfd.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PHonon/FD'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/PHonon'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW'
( cd pw4gww ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/pw4gww'
/bin/rm -fv *.x *.o *~ *_tmp.f90 *.d *.mod *.i *.L libpw4gww.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/pw4gww'
( cd head ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/head'
/bin/rm -fv *.x *.o *.a *~ *_tmp.f90 *.d *.mod *.i *.L
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/head'
( cd gww ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/gww'
/bin/rm -f -v gww.x gww_fit.x *.o *~ *_tmp.f90 *.d *.mod *.i *.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/gww'
( cd minpack ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/minpack'
/bin/rm -fv minpacklib.a *.o
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/minpack'
( cd bse ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/bse'
/bin/rm -f *.x *.o *~ *_tmp.f90 *.d *.mod *.i *.L libbse.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/bse'
( cd simple ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple'
/bin/rm -f *.x *.o *~ *.F90 *.d *.mod *.i *.L libsimple.a
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple'
( cd simple_bse ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple_bse'
/bin/rm -f -v simple_bse.x *.o *~ *.F90 *.d *.mod *.i work.pc
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple_bse'
( cd simple_ip ; make clean )
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple_ip'
/bin/rm -f -v simple_ip.x *.o *~ *.F90 *.d *.mod *.i work.pc
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW/simple_ip'
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/GWW'
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
if test -d ../W90; then (cd ../W90; \
make veryclean); fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0'
cd . && rm -f *~
cd . && rm -f src/*~
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/src/obj'
rm -f *.o *.mod *.MOD *.obj
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/src/obj'
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/src/objp'
rm -f *.o *.mod *.MOD *.obj
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/src/objp'
make -C ./doc/user_guide clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/doc/user_guide'
rm -f *.aux *.log *.lot *.lof *.toc *.dvi *.bak *~ *.bbl *.blg user_guide.ps *.out
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/doc/user_guide'
make -C ./doc/tutorial clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/doc/tutorial'
/bin/rm -f *.aux *.log *.lot *.lof *.toc *.dvi *.bak *~ *.ps
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/doc/tutorial'
make -C ./utility/w90pov clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/utility/w90pov'
rm -fr w90pov obj/*.o *.mod
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/utility/w90pov'
make -C ./utility/w90vdw clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/utility/w90vdw'
rm -f w90vdw.o w90vdw.x
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/utility/w90vdw'
make -C ./test-suite clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/test-suite'
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/test-suite'
cd . && rm -f wannier90.x postw90.x libwannier.a
cd ./doc && rm -f user_guide.pdf tutorial.pdf
cd ./doc/user_guide && rm -f user_guide.ps
cd ./doc/tutorial && rm -f tutorial.ps
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0'
rm -f ../bin/wannier90.x
rm -rf ./make-w90 ./configure-w90
if test -d ../WANT; then (cd ../WANT; \
make clean); fi
rm -rf ./make-want ./configure-want
if test -d ../YAMBO; then (cd ../YAMBO; \
make clean); fi
rm -rf ./make-yambo ./configure-yambo
if test -d ../YAMBO_DEVEL; then (cd ../YAMBO_DEVEL; \
make clean); fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/yambo-devel'
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/yambo-devel'
plugins_makefile:378: recipe for target 'yambo-devel_clean' failed
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
Makefile:298: recipe for target 'clean' failed
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
if test -d ../LAPACK; then (cd ../LAPACK; make clean); fi
if test -d ../ELPA; then (cd ../ELPA; make clean); fi
if test -d ../S3DE; then (cd ../S3DE; make clean); fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/S3DE'
cd iotk ; make clean_
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk'
cd src ; make clean_
make[4]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
rm -f *.a *.o *.mod *.d *.pc *.pcl *.x *.F90
rm -rf ../../iotk/tmp/*
rm -f ../../iotk/bin/*.x
make[4]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk/src'
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/S3DE/iotk'
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/S3DE'
if test -d ../iotk; then (rm -R -f ../iotk); fi
if test -e ../S3DE/iotk/src/iotk.x; then \
rm -f ../S3DE/iotk/src/iotk.x; fi
(rm -f ../bin/iotk; \
rm -f ../bin/iotk.x; \
rm -f ../bin/iotk_print_kinds.x)
if test -d ../FoX; then (rm -R -f ../FoX); fi
if test -d ../EIGENSOLVER_GPU; then (cd ../EIGENSOLVER_GPU/lib_eigsolve ; make clean); fi
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
/bin/rm -rf bin/*.x tempdir
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
if test -d ../W90; then (cd ../W90; \
make veryclean); fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0'
cd . && rm -f *~
cd . && rm -f src/*~
make -C ./doc/user_guide clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/doc/user_guide'
rm -f *.aux *.log *.lot *.lof *.toc *.dvi *.bak *~ *.bbl *.blg user_guide.ps *.out
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/doc/user_guide'
make -C ./doc/tutorial clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/doc/tutorial'
/bin/rm -f *.aux *.log *.lot *.lof *.toc *.dvi *.bak *~ *.ps
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/doc/tutorial'
make -C ./utility/w90pov clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/utility/w90pov'
rm -fr w90pov obj/*.o *.mod
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/utility/w90pov'
make -C ./utility/w90vdw clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/utility/w90vdw'
rm -f w90vdw.o w90vdw.x
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/utility/w90vdw'
make -C ./test-suite clean
make[3]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/test-suite'
make[3]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0/test-suite'
cd . && rm -f wannier90.x postw90.x libwannier.a
cd ./doc && rm -f user_guide.pdf tutorial.pdf
cd ./doc/user_guide && rm -f user_guide.ps
cd ./doc/tutorial && rm -f tutorial.ps
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/wannier90-2.1.0'
rm -f ../bin/wannier90.x
rm -rf ./make-w90 ./configure-w90
if test -d ../W90; then (rm -R -f ../W90); fi
if test -d ../wannier90-2.1.0; then (rm -R -f ../wannier90-2.1.0); fi
rm -f ../bin/wannier90.x
rm -rf ./uncompress-w90
if test -d ../WANT; then (cd ../WANT; \
make clean); fi
rm -rf ./make-want ./configure-want
if test -d ../WANT; then (rm -R -f ../WANT); fi
if test -d ../want; then (rm -R -f ../want); fi
if test -e ../archive/want.tar.gz ; then (rm -f ../archive/want.tar.gz); fi
rm -rf ./uncompress-want ./configure.h
if test -d ../YAMBO; then (cd ../YAMBO; \
make clean); fi
rm -rf ./make-yambo ./configure-yambo
if test -d ../YAMBO; then (rm -R -f ../YAMBO); fi
if test -d ../yambo-stable; then (rm -R -f ../yambo-stable); fi
rm -rf ./uncompress-yambo
if test -d ../YAMBO_DEVEL; then (cd ../YAMBO_DEVEL; \
make clean); fi
make[2]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/yambo-devel'
make[2]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/yambo-devel'
plugins_makefile:378: recipe for target 'yambo-devel_clean' failed
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
Makefile:317: recipe for target 'veryclean' failed
make[1]: Entering directory '/home/chris/Downloads/qe-6.3/q-e/install'
if test -d ../LAPACK; then (rm -R -f ../LAPACK ../lapack-3.6.1); fi
if test -d ../ELPA; then (rm -R -f ../ELPA); fi
if test -d ../S3DE; then (rm -R -f ../S3DE); fi
if test -d ../iotk; then (rm -R -f ../iotk); fi
if test -e ../S3DE/iotk/src/iotk.x; then (rm -f ../S3DE/iotk/src/iotk.x); fi
rm -f ../bin/iotk; \
rm -f ../bin/iotk.x; \
rm -f ../bin/iotk_print_kinds.x; \
rm -f ../iotk
if test -d ../FoX; then (rm -R -f ../FoX); fi
if test -d ../EIGENSOLVER_GPU; then (rm -R -f ../EIGENSOLVER_GPU ../Eigensolver_gpu-0.3); fi
make[1]: Leaving directory '/home/chris/Downloads/qe-6.3/q-e/install'
rm -rf install/patch-plumed
cd install ; rm -f config.log configure.msg config.status \
CPV/version.h ChangeLog* intel.pcl */intel.pcl
rm -rf include/configure.h install/make_wannier90.inc
cd install ; rm -fr autom4te.cache
cd install; ./clean.sh ; cd -
/home/chris/Downloads/qe-6.3/q-e
cd include; ./clean.sh ; cd -
/home/chris/Downloads/qe-6.3/q-e
rm -f espresso.tar.gz -
rm -rf make.inc -
rm -rf FoX
checking build system type... x86_64-pc-linux-gnu
checking ARCH... x86_64
checking setting AR... ... ar
checking setting ARFLAGS... ... ruv
checking whether the Fortran compiler works... yes
checking for Fortran compiler default output file name... a.out
checking for suffix of executables...
checking whether we are cross compiling... no
checking for suffix of object files... o
checking whether we are using the GNU Fortran compiler... yes
checking whether mpifort accepts -g... yes
checking for gcc... mpicc
checking whether we are using the GNU C compiler... yes
checking whether mpicc accepts -g... yes
checking for mpicc option to accept ISO C89... none needed
checking whether we are using the GNU Fortran compiler... (cached) yes
checking whether mpifort accepts -g... (cached) yes
checking for Fortran flag to compile .f90 files... none
checking for mpif90... mpif90
checking whether we are using the GNU Fortran compiler... yes
checking whether mpif90 accepts -g... yes
checking version of mpif90... gfortran 5.4
setting F90... gfortran
setting MPIF90... mpif90
checking whether we are using the GNU C compiler... (cached) yes
checking whether mpicc accepts -g... (cached) yes
checking for mpicc option to accept ISO C89... (cached) none needed
setting CC... mpicc
setting CFLAGS... -O3
checking whether we are using the GNU Fortran 77 compiler... yes
checking whether mpifort accepts -g... yes
setting F77... mpifort
using F90... gfortran
setting FFLAGS... -O3 -g
setting F90FLAGS... $(FFLAGS) -x f95-cpp-input
setting FFLAGS_NOOPT... -O0 -g
setting CPP... cpp
setting CPPFLAGS... -P -traditional
setting LD... mpif90
setting LDFLAGS... -g
checking whether make sets $(MAKE)... yes
checking whether Fortran files must be preprocessed... no
checking for library containing dgemm... -lmkl_gf_lp64
setting BLAS_LIBS... -lmkl_gf_lp64 -lmkl_sequential -lmkl_core
checking for library containing dspev... none required
checking how to run the C preprocessor... mpicc -E
checking for grep that handles long lines and -e... /bin/grep
checking for egrep... /bin/grep -E
checking for ANSI C header files... yes
checking for sys/types.h... yes
checking for sys/stat.h... yes
checking for stdlib.h... yes
checking for string.h... yes
checking for memory.h... yes
checking for strings.h... yes
checking for inttypes.h... yes
checking for stdint.h... yes
checking for unistd.h... yes
checking FFT... checking for DftiComputeForward in -lmkl_intel_lp64... yes
checking for /opt/intel/Compiler/*/*/mkl/include/mkl_dfti.f90... no
checking for /opt/intel/mkl/*/include/mkl_dfti.f90... no
checking for /opt/intel/mkl/include/mkl_dfti.f90... yes
-L/opt/intel/compilers_and_libraries_2018.0.128/linux/mkl/intel64
checking MASS...
checking for library containing mpi_init... none required
checking for library containing pdgemr2d... no
checking for library containing pdgemr2d... -lmkl_scalapack_lp64
checking ELPA...
checking for ranlib... ranlib
checking for wget... wget -O
setting WGET... wget -O
setting DFLAGS... -D__DFTI -D__MPI -D__SCALAPACK
setting IFLAGS... -I$(TOPDIR)/include -I$(TOPDIR)/FoX/finclude -I$(TOPDIR)/S3DE/iotk/include/ -I/opt/intel/mkl/include
configure: creating ./config.status
config.status: creating install/make_lapack.inc
config.status: creating include/configure.h
config.status: creating make.inc
config.status: creating configure.msg
config.status: creating install/make_wannier90.inc
config.status: creating include/c_defs.h
--------------------------------------------------------------------
ESPRESSO can take advantage of several optimized numerical libraries
(essl, fftw, mkl...). This configure script attempts to find them,
but may fail if they have been installed in non-standard locations.
If a required library is not found, the local copy will be compiled.
The following libraries have been found:
BLAS_LIBS= -lmkl_gf_lp64 -lmkl_sequential -lmkl_core
LAPACK_LIBS=
SCALAPACK_LIBS=-lmkl_scalapack_lp64 -lmkl_blacs_intelmpi_lp64
FFT_LIBS=-L/opt/intel/compilers_and_libraries_2018.0.128/linux/mkl/intel64
Please check if this is what you expect.
If any libraries are missing, you may specify a list of directories
to search and retry, as follows:
./configure LIBDIRS="list of directories, separated by spaces"
Parallel environment detected successfully.\
Configured for compilation of parallel executables.
For more info, read the ESPRESSO User's Guide (Doc/users-guide.tex).
--------------------------------------------------------------------
configure: success
make.inc
Description: Binary data
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